SCHEMBL696687

SCHEMBL696687

OCc1ccc(-n2cncn2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.55
KDM4E B2RXH2 1/20 0.55
ALDH1A1 P00352 1/20 0.55
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
CYP2A6 P11509 1/20 0.46
HSP90AA1 P07900 1/20 0.44
MAPT P10636 1/20 0.44
HTT P42858 1/20 0.44
FBP1 P09467 1/20 0.44
DPP4 P27487 2/20 0.43
DPP8 Q6V1X1 1/20 0.43
VHL P40337 1/20 0.42
ELOC Q15369 1/20 0.42
ELOB Q15370 1/20 0.42
CYP11B2 P19099 2/20 0.42
BRS3 P32247 1/20 0.42
RAB9A P51151 2/20 0.41

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
SCHEMBL6852241 0.85 SMN1; SMN2 (0.51) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL19567209 0.82 SMN1; SMN2 (0.56) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL6853892 0.82 CYP1A2 (0.49) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL6869977 0.81 SMN1; SMN2 (0.55) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL4573341 0.81 SMN1; SMN2 (0.55) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL6847934 0.81 SMN1; SMN2 (0.55) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL179126 0.81 CYP1A2 (0.58) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL4573347 0.81 SMN1; SMN2 (0.55) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL676381 0.81 SMN1; SMN2 (0.55) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6
SCHEMBL13109196 0.81 SMN1; SMN2 (0.55) SMN1; SMN2KDM4EALDH1A1CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117000047-B Oxidation-resistant, antibacterial and high-flux reverse osmosis membrane and preparation method and application thereof 万华化学集团股份有限公司 2026-05-19 CN disclosed
US-12016852-B2 Pyrrolidine glycosidase inhibitors ASCENEURON SA (CH) 2024-06-25 US disclosed
US-12016852-B2 Pyrrolidine glycosidase inhibitors ASCENEURON SA (CH) 2024-06-25 US disclosed
CN-117000047-A Oxidation-resistant, antibacterial and high-flux reverse osmosis membrane and preparation method and application thereof 万华化学集团股份有限公司 2023-11-07 CN disclosed
US-20210213005-A1 PYRROLIDINE GLYCOSIDASE INHIBITORS ASCENEURON SA (CH) 2021-07-15 US disclosed
US-20210213005-A1 PYRROLIDINE GLYCOSIDASE INHIBITORS ASCENEURON SA (CH) 2021-07-15 US disclosed
WO-2020039027-A1 PYRROLIDINE GLYCOSIDASE INHIBITORS ASCENEURON S. A. (CH) 2020-02-27 WO disclosed
US-9273017-B2 (Thio)morpholine derivatives as S1P modulators ABBVIE BAHAMAS LIMITED (BS) 2016-03-01 US disclosed
US-9273017-B2 (Thio)morpholine derivatives as S1P modulators ABBVIE BAHAMAS LIMITED (BS) 2016-03-01 US disclosed
US-20150239857-A1 (THIO)MORPHOLINE DERIVATIVES AS S1P MODULATORS ABBVIE BAHAMAS LIMITED (BS) 2015-08-27 US disclosed
US-20070167506-A1 SUBSTITUTED IMIDAZOLES PFIZER INC. (US) 2007-07-19 US disclosed
CN-1585775-A 6-O-acyl ketolide derivatives of erythromycine useful as antibacterials ORTHO MCNEIL PHARM INC (US) 2005-02-23 CN disclosed
US-6825170-B2 ERYTHROMYCIN TYPE MACROLIDE WITH A FUSED OXAZOLONE RING ORTHO-MCNEIL PHARMACEUTICAL, INC. 2004-11-30 US disclosed
EP-1453847-A1 6-O-ACYL KETOLIDE DERIVATIVES OF ERYTHROMYCINE USEFUL AS ANTIBACTERIALS Ortho-Mcneil Pharmaceutical, Inc. (US) 2004-09-08 EP disclosed
US-6680312-B2 FOR THERAPY OF CARDIAC INFARCTION, CEREBRAL THROMBOSIS; INHIBIT ACTIVATED COAGULATION FACTOR X (FXA) TO SHOW ANTI-COAGULANT ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2004-01-20 US disclosed
US-20030220272-A1 6-O-acyl ketolide antibacterials ORTHO-MCNEIL PHARMACEUTICAL, INC. 2003-11-27 US disclosed
WO-2003050132-A1 6-O-ACYL KETOLIDE DERIVATIVES OF ERYTHROMYCINE USEFUL AS ANTIBACTERIALS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2003-06-19 WO disclosed
US-20020193382-A1 Sulfonamide derivatives, their production and use TAKEDA PHARMACEUTICAL COMPANY, LIMITED (JP) 2002-12-19 US disclosed
US-6403595-B1 ANTICOAGULANTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-06-11 US disclosed
EP-1054005-A1 SULFONAMIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND UTILIZATION THEREOF Takeda Chemical Industries, Ltd. (JP) 2000-11-22 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 (6 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-20030220272-A1 6-O-acyl ketolide antibacterials Q6ZSR9, ACSL6, RPS4Y1 SMN1; SMN2 4073/4885KDM4E 18/4885ALDH1A1 2109/4885
US-20150239857-A1 (THIO)MORPHOLINE DERIVATIVES AS S1P MODULATORS S1PR3, S1PR1, S1PR2 SMN1; SMN2 3101/4885KDM4E 716/4885ALDH1A1 3506/4885
US-12016852-B2 Pyrrolidine glycosidase inhibitors PREP, GAA, DNPEP SMN1; SMN2 2473/4885KDM4E 2209/4885ALDH1A1 1182/4885
US-20210213005-A1 PYRROLIDINE GLYCOSIDASE INHIBITORS PREP, GAA, DNPEP SMN1; SMN2 2327/4885KDM4E 1934/4885ALDH1A1 1170/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 SMN1; SMN2 1394/4885KDM4E 574/4885ALDH1A1 617/4885
US-20020193382-A1 Sulfonamide derivatives, their production and use F12, F11, F2 SMN1; SMN2 2803/4885KDM4E 1392/4885ALDH1A1 2304/4885

“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.