SCHEMBL6663882

SCHEMBL6663882

COC(=O)C(c1ccccc1)N1CCN(C)CC1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.73
LMNA P02545 2/20 0.73
ALDH1A1 P00352 2/20 0.73
MEN1 O00255 1/20 0.73
OPRM1 P35372 2/20 0.64
OPRK1 P41145 1/20 0.64
OPRL1 P41146 1/20 0.64
NPY2R P49146 5/20 0.55
CHRM2 P08172 2/20 0.53
CHRM1 P11229 2/20 0.53
CHRM3 P20309 2/20 0.53
CHRM4 P08173 1/20 0.53
CHRM5 P08912 1/20 0.53
ADRA2A P08913 1/20 0.53
ADORA3 P0DMS8 1/20 0.53
CYP2D6 P10635 1/20 0.53
DRD1 P21728 1/20 0.53
ADRA1D P25100 1/20 0.53
HTR2A P28223 1/20 0.53
HTR2C P28335 1/20 0.53

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
SCHEMBL7657250 0.87 LMNA (0.94) KMT2ALMNAALDH1A1MEN1OPRM1
SCHEMBL1819794 0.86 LMNA (0.97) KMT2ALMNAALDH1A1MEN1OPRM1
SCHEMBL2789416 0.86 LMNA (0.97) KMT2ALMNAALDH1A1MEN1OPRM1
SCHEMBL6641491 0.85 KMT2A (0.69) KMT2ALMNAALDH1A1MEN1OPRM1
SCHEMBL14590786 0.85 ALDH1A1 (0.69) KMT2ALMNAALDH1A1MEN1OPRM1
SCHEMBL27817324 0.85 ALDH1A1 (0.54) KMT2ALMNAALDH1A1MEN1OPRM1
Hydrochloric Acid SCHEMBL5606289 0.84 LMNA (1.00) KMT2ALMNAALDH1A1MEN1OPRM1
SCHEMBL6639844 0.84 ALDH1A1 (0.64) KMT2ALMNAALDH1A1MEN1OPRM1
SCHEMBL753058 0.84 LMNA (0.52) KMT2ALMNAALDH1A1MEN1OPRM1
SCHEMBL18526696 0.84 LMNA (0.52) KMT2ALMNAALDH1A1MEN1OPRM1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250346616-A1 ROCK INHIBITORS AND USES THEREOF DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2025-11-13 US disclosed
EP-4532484-A1 ROCK INHIBITORS AND USES THEREOF DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2025-04-09 EP disclosed
CN-119173509-A ROCK inhibitors and uses thereof 迪哲(江苏)医药股份有限公司 2024-12-20 CN disclosed
WO-2023226965-A1 ROCK INHIBITORS AND USES THEREOF DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2023-11-30 WO disclosed
EP-1250340-B1 METHODS AND COMPOUNDS FOR INHIBITING MRP1 LILLY CO ELI (US) 2004-11-17 EP disclosed
US-20040176405-A1 Methods and compounds for inhibitting MRP1 KROIN JULIAN (US) 2004-09-09 US disclosed
US-6743794-B2 MULTIDRUG RESISTANCE PROTEIN; CANCER; 3-(9-CHLORO-3-METHYL-4-OXO-5H-ISOXAZOLO(4,3-C)QUINOLIN-5-YL)) CYCLOHEXYL)-2-PIPERIDYLACETAMIDE ELI LILLY AND COMPANY 2004-06-01 US disclosed
US-20030100576-A1 Methods and compounds for inhibiting mrp1 ELI LILLY AND COMPANY 2003-05-29 US disclosed
EP-1250340-A1 METHODS AND COMPOUNDS FOR INHIBITING MRP1 ELI LILLY AND COMPANY (US) 2002-10-23 EP disclosed
WO-2001046199-A1 METHODS AND COMPOUNDS FOR INHIBITING MRP1 ELI LILLY AND COMPANY (US) 2001-06-28 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 (3 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-20250346616-A1 ROCK INHIBITORS AND USES THEREOF ROCK1, ROCK2, RHOA KMT2A 3598/4885LMNA 2579/4885ALDH1A1 2229/4885
US-20040176405-A1 Methods and compounds for inhibitting MRP1 ABCC1, ABCB11, ABCB1 KMT2A 4688/4885LMNA 2547/4885ALDH1A1 208/4885
US-20030100576-A1 Methods and compounds for inhibiting mrp1 ABCC1, ABCB11, ABCB1 KMT2A 4622/4885LMNA 2226/4885ALDH1A1 264/4885

“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.