SCHEMBL7488776

SCHEMBL7488776

NCC(O)c1cccc(OCc2ccccc2)c1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.60
KMT2A Q03164 2/20 0.60
MAOB P27338 4/20 0.55
LMNA P02545 1/20 0.55
HPGD P15428 1/20 0.55
ALOX15 P16050 1/20 0.55
TSHR P16473 1/20 0.55
MAPK1 P28482 1/20 0.55
HTT P42858 1/20 0.55
CYP4F2 P78329 1/20 0.53
CYP4A11 Q02928 1/20 0.53
MEN1 O00255 1/20 0.52
NR4A2 P43354 1/20 0.51
SGMS2 Q8NHU3 1/20 0.51
ALOX5 P09917 2/20 0.49
BCHE P06276 2/20 0.49

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
SCHEMBL2207119 0.88 KMT2A (0.58) SMN1; SMN2KMT2AMAOBLMNAHPGD
SCHEMBL29818763 0.88 KMT2A (0.58) SMN1; SMN2KMT2AMAOBLMNAHPGD
SCHEMBL10477884 0.88 KMT2A (0.53) SMN1; SMN2KMT2AMAOBLMNAHPGD
SCHEMBL7145799 0.88 KMT2A (0.53) SMN1; SMN2KMT2AMAOBLMNAHPGD
SCHEMBL19850488 0.88 SMN1; SMN2 (0.48) SMN1; SMN2KMT2AMAOBLMNAHPGD
SCHEMBL19871712 0.88 SMN1; SMN2 (0.48) SMN1; SMN2KMT2AMAOBLMNAHPGD
SCHEMBL19850428 0.88 SMN1; SMN2 (0.48) SMN1; SMN2KMT2AMAOBLMNAHPGD
Hydrochloric Acid SCHEMBL16030632 0.87 KMT2A (0.56) SMN1; SMN2KMT2AMAOBLMNAHPGD
SCHEMBL12269320 0.86 SMN1; SMN2 (0.47) SMN1; SMN2KMT2AMAOBLMNAHPGD
SCHEMBL3443080 0.86 KMT2A (0.58) SMN1; SMN2KMT2AMAOBLMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11986471-B2 Compounds and methods of use TANGO THERAPEUTICS, INC. (US) 2024-05-21 US disclosed
US-20230060499-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2023-03-02 US disclosed
US-20230060499-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2023-03-02 US disclosed
EP-3194367-B1 TETRAHYDROISOQUINOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR THE TREATMENT OF OBESITY AND DIABETES BOEHRINGER INGELHEIM INT (DE) 2021-08-18 EP disclosed
EP-3194367-B1 TETRAHYDROISOQUINOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR THE TREATMENT OF OBESITY AND DIABETES BOEHRINGER INGELHEIM INT (DE) 2021-08-18 EP disclosed
US-11077101-B1 Compounds and methods of use TANGO THERAPEUTICS, INC. (US) 2021-08-03 US disclosed
US-11077101-B1 Compounds and methods of use TANGO THERAPEUTICS, INC. (US) 2021-08-03 US disclosed
EP-3194367-A1 TETRAHYDROISOQUINOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR THE TREATMENT OF OBESITY AND DIABETES Boehringer Ingelheim International GmbH (DE) 2017-07-26 EP disclosed
US-9340510-B2 Tetrahydroisoquinoline derivatives, pharmaceutical compositions and uses thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-05-17 US disclosed
US-9340510-B2 Tetrahydroisoquinoline derivatives, pharmaceutical compositions and uses thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-05-17 US disclosed
US-9340510-B2 Tetrahydroisoquinoline derivatives, pharmaceutical compositions and uses thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-05-17 US disclosed
WO-2016041845-A1 TETRAHYDROISOQUINOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR THE TREATMENT OF OBESITY AND DIABETES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-03-24 WO disclosed
US-20160075657-A1 Tetrahydroisoquinoline derivatives, pharmaceutical compositions and uses thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-03-17 US disclosed
US-20160075657-A1 Tetrahydroisoquinoline derivatives, pharmaceutical compositions and uses thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-03-17 US disclosed
EP-0825189-B1 1,4-BENZODIOXIN DERIVATIVES NISSHIN PHARMA INC (JP) 2002-01-02 EP disclosed
US-6130243-A PROPHYLACTIC OR THERAPEUTIC AGENT FOR DIABETES, HYPERGLYCEMIA AND OBESITY IN MAMMALS NISSHIN FLOUR MILLING CO., LTD. (JP) 2000-10-10 US disclosed
EP-0825189-A1 1,4-BENZODIOXIN DERIVATIVES NISSHIN FLOUR MILLING CO., LTD. (JP) 1998-02-25 EP 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 (4 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-20160075657-A1 Tetrahydroisoquinoline derivatives, pharmaceutical compositions and uses thereof QDPR, RECQL, TPMT SMN1; SMN2 3350/4885KMT2A 1979/4885MAOB 933/4885
US-11986471-B2 Compounds and methods of use XDH, F12, LPXN SMN1; SMN2 1178/4885KMT2A 3722/4885MAOB 290/4885
US-11077101-B1 Compounds and methods of use XDH, F12, LPXN SMN1; SMN2 1178/4885KMT2A 3722/4885MAOB 290/4885
US-20230060499-A1 COMPOUNDS AND METHODS OF USE XDH, F12, LPXN SMN1; SMN2 1178/4885KMT2A 3722/4885MAOB 290/4885

“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.