SCHEMBL745588

SCHEMBL745588

Cn1c(=O)sc2cc(Br)ccc21

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 9/20 0.48
POLB P06746 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
MAPT P10636 3/20 0.44
HTR1A P08908 3/20 0.43
HTR2C P28335 2/20 0.43
CYP19A1 P11511 1/20 0.42
TP53 P04637 2/20 0.41
MCL1 Q07820 1/20 0.40
THRB P10828 1/20 0.40

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
SCHEMBL31347592 0.88 POLB (0.45) SIGMAR1POLBRXFP1MAPTHTR1A
SCHEMBL29704509 0.85 SIGMAR1 (0.47) SIGMAR1POLBRXFP1MAPTMCL1
SCHEMBL19644301 0.85 SIGMAR1 (0.47) SIGMAR1POLBRXFP1MAPTMCL1
SCHEMBL4616475 0.79 MAPT (0.51) SIGMAR1RXFP1MAPTHTR1AHTR2C
SCHEMBL14681114 0.78 SIGMAR1 (0.59) SIGMAR1MAPTTP53
SCHEMBL8281885 0.78 SIGMAR1 (0.45) SIGMAR1MAPTHTR1AHTR2CCYP19A1
SCHEMBL3035789 0.78 BRPF1 (0.47) SIGMAR1MAPTHTR1AHTR2CCYP19A1
SCHEMBL4614580 0.78 SIGMAR1 (0.53) SIGMAR1MAPTHTR1AHTR2CCYP19A1
SCHEMBL4615636 0.78 HTR1A (0.45) SIGMAR1MAPTHTR1AHTR2CCYP19A1
SCHEMBL12301898 0.78 POLB (0.48) SIGMAR1POLBRXFP1MAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12435128-B2 Method for predicting therapeutic effect of LSD1 inhibitor based on expression of INSM1 TAIHO PHARMACEUTICAL CO., LTD. (JP) 2025-10-07 US disclosed
WO-2025021062-A1 TRICYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2025-01-30 WO disclosed
CN-110740991-B Novel biphenyl compound or salt thereof 大鹏药品工业株式会社 2023-07-04 CN disclosed
CN-115028646-B Nitrogen-containing heterocyclic compound, preparation method and application thereof in antitumor preparation 山东第一医科大学(山东省医学科学院) 2023-06-30 CN disclosed
EP-3632443-B1 ANTI-TUMOR EFFECT POTENTIATOR USING A BIPHENYL COMPOUND TAIHO PHARMACEUTICAL CO LTD (JP) 2023-06-07 EP disclosed
EP-3381896-B1 BIPHENYL COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2023-01-18 EP disclosed
US-11510915-B2 Anti-tumor effect potentiator using novel biphenyl compound TAIHO PHARMACEUTICAL CO., LTD. (JP) 2022-11-29 US disclosed
US-11479563-B2 Biphenyl compound or salt thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2022-10-25 US disclosed
CN-115028646-A Nitrogen-containing heterocyclic compound, preparation method and application in antitumor preparation 山东第一医科大学(山东省医学科学院) 2022-09-09 CN disclosed
CN-113087683-B Nitrogen-substituted benzothiazolinone XOR/URAT1 dual inhibitor and preparation method and application thereof 华南理工大学 2022-04-22 CN disclosed
US-20120071512-A1 5-PYRIDIN-3-YL-1, 3-DIHYDRO-INDOL-2-ON DERIVATIVES AND THEIR USE AS MODULATORS OF ALDOSTERONE SYNTHASE AND/OR CYP11B1 NOVARTIS AG (CH) 2012-03-22 US disclosed
US-20120071512-A1 5-PYRIDIN-3-YL-1, 3-DIHYDRO-INDOL-2-ON DERIVATIVES AND THEIR USE AS MODULATORS OF ALDOSTERONE SYNTHASE AND/OR CYP11B1 NOVARTIS AG (CH) 2012-03-22 US disclosed
US-20120071512-A1 5-PYRIDIN-3-YL-1, 3-DIHYDRO-INDOL-2-ON DERIVATIVES AND THEIR USE AS MODULATORS OF ALDOSTERONE SYNTHASE AND/OR CYP11B1 NOVARTIS AG (CH) 2012-03-22 US disclosed
EP-2430011-A1 5-PYRIDIN-3-YL-1,3-DIHYDRO-INDOL-2-ON DERIVATIVES AND THEIR USE AS MODULATORS OF ALDOSTERONE SYNTHASE AND/OR CYP11B1 Novartis AG (CH) 2012-03-21 EP disclosed
US-20110201581-A1 Novel Compounds 010 ASTRAZENECA AB (SE) 2011-08-18 US disclosed
US-7902181-B2 Compounds 010 ASTRAZENECA AB (SE) 2011-03-08 US disclosed
WO-2010130794-A1 5-PYRIDIN-3-YL-1,3-DIHYDRO-INDOL-2-ON DERIVATIVES AND THEIR USE AS MODULATORS OF ALDOSTERONE SYNTHASE AND/OR CYP11B1 NOVARTIS AG (CH) 2010-11-18 WO disclosed
EP-2231597-A1 PEPTIDYL NITRILES AND USE THEREOF AS DIPEPTIDYL PEPTIDASE I INHIBITORS AstraZeneca AB (SE) 2010-09-29 EP disclosed
US-20090306042-A1 Novel Compounds 010 ASTRAZENECA AB (SE) 2009-12-10 US disclosed
WO-2009074829-A1 PEPTIDYL NITRILES AND USE THEREOF AS DIPEPTIDYL PEPTIDASE I INHIBITORS ASTRAZENECA AB (SE) 2009-06-18 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 (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-11479563-B2 Biphenyl compound or salt thereof BMI1, KDM1B, KDM1A SIGMAR1 2950/4885POLB 2241/4885RXFP1 2442/4885
US-12435128-B2 Method for predicting therapeutic effect of LSD1 inhibitor based on expression of INSM1 INMT, CARM1, KDM1B SIGMAR1 3798/4885POLB 2534/4885RXFP1 1020/4885
US-20090306042-A1 Novel Compounds 010 MRGPRX2, F12, TBXA2R SIGMAR1 229/4885POLB 2456/4885RXFP1 83/4885
US-20120071512-A1 5-PYRIDIN-3-YL-1, 3-DIHYDRO-INDOL-2-ON DERIVATIVES AND THEIR USE AS MODULATORS OF ALDOSTERONE SYNTHASE AND/OR CYP11B1 CYP11B1, HSD11B1, CYP11B2 SIGMAR1 3025/4885POLB 2259/4885RXFP1 1278/4885
US-20110201581-A1 Novel Compounds 010 MRGPRX2, F12, TBXA2R SIGMAR1 229/4885POLB 2456/4885RXFP1 83/4885
US-11510915-B2 Anti-tumor effect potentiator using novel biphenyl compound KDM1B, KDM1A, DOT1L SIGMAR1 2124/4885POLB 1913/4885RXFP1 552/4885

“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.