SCHEMBL3757797

SCHEMBL3757797

COc1ccc(OC)c(NC(=O)CCl)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.73
NPSR1 Q6W5P4 1/20 0.73
ALDH1A1 P00352 6/20 0.64
GAA P10253 3/20 0.64
KDM4E B2RXH2 1/20 0.64
CYP1A2 P05177 1/20 0.64
CYP3A4 P08684 1/20 0.64
CYP2C9 P11712 1/20 0.64
MAPK1 P28482 1/20 0.64
CYP2C19 P33261 1/20 0.64
TP53 P04637 1/20 0.61
POLB P06746 3/20 0.60
MEN1 O00255 3/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
MAPT P10636 2/20 0.59
LMNA P02545 1/20 0.59
RGS12 O14924 1/20 0.59
HPGD P15428 1/20 0.59
HTT P42858 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2875266 0.90 KMT2A (0.68) KMT2ANPSR1ALDH1A1GAAKDM4E
SCHEMBL1494291 0.88 ALDH1A1 (0.79) KMT2AALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL5807392 0.86 KMT2A (0.75) KMT2ANPSR1ALDH1A1GAAKDM4E
SCHEMBL6594370 0.86 KMT2A (0.75) KMT2ANPSR1ALDH1A1GAAKDM4E
SCHEMBL9316115 0.85 POLB (0.69) KMT2ANPSR1ALDH1A1GAAKDM4E
SCHEMBL9468747 0.84 KMT2A (0.82) KMT2ANPSR1ALDH1A1KDM4ECYP1A2
SCHEMBL10684407 0.84 SMN1; SMN2 (0.68) KMT2AALDH1A1GAAPOLBMEN1
SCHEMBL17662314 0.84 KMT2A (0.73) KMT2ANPSR1ALDH1A1GAAKDM4E
SCHEMBL20189628 0.84 KMT2A (0.73) KMT2ANPSR1ALDH1A1GAAKDM4E
SCHEMBL5807397 0.84 KMT2A (0.73) KMT2ANPSR1ALDH1A1GAAKDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12605468-B2 Oxazine-based fluorophore compounds for nerve-specific imaging OREGON HEALTH & SCIENCE UNIVERSITY (US) 2026-04-21 US disclosed
US-20230148317-A1 OXAZINE-BASED FLUOROPHORE COMPOUNDS FOR NERVE-SPECIFIC IMAGING OREGON HEALTH & SCIENCE UNIVERSITY (US) 2023-05-11 US disclosed
US-20230148317-A1 OXAZINE-BASED FLUOROPHORE COMPOUNDS FOR NERVE-SPECIFIC IMAGING OREGON HEALTH & SCIENCE UNIVERSITY (US) 2023-05-11 US disclosed
US-20230148317-A1 OXAZINE-BASED FLUOROPHORE COMPOUNDS FOR NERVE-SPECIFIC IMAGING OREGON HEALTH & SCIENCE UNIVERSITY (US) 2023-05-11 US disclosed
EP-4093443-A1 OXAZINE-BASED FLUOROPHORE COMPOUNDS FOR NERVE-SPECIFIC IMAGING Oregon Health & Science University (US) 2022-11-30 EP disclosed
US-11492359-B2 Near-infrared nerve-sparing fluorophores OREGON HEALTH & SCIENCE UNIVERSITY (US) 2022-11-08 US disclosed
US-20210317137-A1 NEAR-INFRARED NERVE-SPARING FLUOROPHORES OREGON HEALTH & SCIENCE UNIVERSITY (US) 2021-10-14 US disclosed
US-20210317137-A1 NEAR-INFRARED NERVE-SPARING FLUOROPHORES OREGON HEALTH & SCIENCE UNIVERSITY (US) 2021-10-14 US disclosed
US-20210236657-A1 NERVE-SPECIFIC FLUOROPHORE FORMULATIONS FOR DIRECT AND SYSTEMIC ADMINISTRATION OREGON HEALTH & SCIENCE UNIVERSITY (US) 2021-08-05 US disclosed
US-20210236657-A1 NERVE-SPECIFIC FLUOROPHORE FORMULATIONS FOR DIRECT AND SYSTEMIC ADMINISTRATION OREGON HEALTH & SCIENCE UNIVERSITY (US) 2021-08-05 US disclosed
WO-2016153242-A1 PHARMACEUTICAL COMPOSITION FOR TREATING OR PREVENTING CENTRAL NERVOUS SYSTEM DISEASE 재단법인 경기과학기술진흥원 2016-09-29 WO disclosed
US-8679776-B2 Activatable dyes UNIVERSITY OF MASSACHUSETTS (US) 2014-03-25 US disclosed
US-20100297684-A1 ACTIVATIBLE DYES UNIVERSITY OF MASSACHUSETTS 2010-11-25 US disclosed
US-7528134-B2 Acetamides and benzamides that are useful in treating sexual dysfunction ABBOTT LABORATORIES INC. (US) 2009-05-05 US disclosed
WO-2009036351-A2 ACTIVATIBLE DYES UNIVERSITY OF MASSACHUSETTS (US) 2009-03-19 WO disclosed
US-20060009461-A1 Acetamides and benzamides that are useful in treating sexual dysfunction BHATIA PRAMILA A 2006-01-12 US disclosed
EP-1509213-A2 ACETAMIDES AND BENZAMIDES THAT ARE USEFUL IN TREATING SEXUAL DYSFUNCTION Abbott Laboratories (US) 2005-03-02 EP disclosed
US-20040029887-A1 Acetamides and benzamides that are useful in treating sexual dysfunction ABBOTT LABORATORIES 2004-02-12 US disclosed
US-20030229094-A1 Acetamides and benzamides that are useful in treating sexual dysfunction ABBOTT LABORATORIES 2003-12-11 US disclosed
WO-2003099266-A2 ACETAMIDES AND BENZAMIDES THAT ARE USEFUL IN TREATING SEXUAL DYSFUNCTION ABBOTT LABORATORIES (US) 2003-12-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030229094-A1 Acetamides and benzamides that are useful in treating sexual dysfunction CATSPER1, CYP19A1, PDE12 KMT2A 2169/4885NPSR1 1468/4885ALDH1A1 88/4885
US-11492359-B2 Near-infrared nerve-sparing fluorophores NTRK1, PMP22, GAP43 KMT2A 2855/4885NPSR1 460/4885ALDH1A1 813/4885
US-20210236657-A1 NERVE-SPECIFIC FLUOROPHORE FORMULATIONS FOR DIRECT AND SYSTEMIC ADMINISTRATION PFAS, NPFFR2, NPFFR1 KMT2A 3779/4885NPSR1 396/4885ALDH1A1 1305/4885
US-20230148317-A1 OXAZINE-BASED FLUOROPHORE COMPOUNDS FOR NERVE-SPECIFIC IMAGING GAP43, NTRK1, CHAT KMT2A 3803/4885NPSR1 1773/4885ALDH1A1 1300/4885
US-20040029887-A1 Acetamides and benzamides that are useful in treating sexual dysfunction CATSPER1, CYP19A1, PDE12 KMT2A 2169/4885NPSR1 1468/4885ALDH1A1 88/4885
US-20060009461-A1 Acetamides and benzamides that are useful in treating sexual dysfunction PDE12, NAAA, CYP19A1 KMT2A 1792/4885NPSR1 1595/4885ALDH1A1 193/4885
US-20100297684-A1 ACTIVATIBLE DYES IK, MB, HMBS KMT2A 2859/4885NPSR1 3872/4885ALDH1A1 856/4885
US-12605468-B2 Oxazine-based fluorophore compounds for nerve-specific imaging CHRNB2, CHRNB3, CHRNB4 KMT2A 4441/4885NPSR1 561/4885ALDH1A1 1339/4885
US-20210317137-A1 NEAR-INFRARED NERVE-SPARING FLUOROPHORES NTRK1, NGF, SMN1; SMN2 KMT2A 4578/4885NPSR1 878/4885ALDH1A1 822/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.