SCHEMBL88685

SCHEMBL88685

S=C1Cc2ccccc2N1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 1.00
MAPT P10636 3/20 1.00
MEN1 O00255 3/20 1.00
NPC1 O15118 2/20 1.00
KDM4E B2RXH2 2/20 1.00
HSP90AA1 P07900 1/20 1.00
THRB P10828 1/20 1.00
HK1 P19367 1/20 1.00
MAPK1 P28482 1/20 1.00
RECQL P46063 1/20 1.00
RAB9A P51151 1/20 1.00
GALK1 P51570 1/20 1.00
BLM P54132 1/20 1.00
HKDC1 Q2TB90 1/20 1.00
AHR P35869 1/20 0.56
PDK2 Q15119 1/20 0.56
ALDH1A1 P00352 2/20 0.45
ALOX15 P16050 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MAPK13 O15264 1/20 0.43

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
SCHEMBL29453856 1.00 KMT2A (1.00) KMT2AMAPTMEN1NPC1KDM4E
Fluorene SCHEMBL28370298 0.90 NPC1 (0.81) KMT2AMAPTMEN1NPC1KDM4E
Acridan SCHEMBL20594012 0.79 MAPT (0.65) KMT2AMAPTMEN1NPC1KDM4E
Acridan SCHEMBL29446489 0.79 MAPT (0.65) KMT2AMAPTMEN1NPC1KDM4E
Acridan SCHEMBL183367 0.79 MAPT (0.65) KMT2AMAPTMEN1NPC1KDM4E
Acridan SCHEMBL29405807 0.79 MAPT (0.65) KMT2AMAPTMEN1NPC1KDM4E
SCHEMBL88725 0.79 MEN1 (0.65) KMT2AMAPTMEN1NPC1KDM4E
SCHEMBL4571016 0.77 MAPT (0.62) KMT2AMAPTMEN1NPC1KDM4E
Acridan SCHEMBL15412652 0.77 MAPT (0.62) KMT2AMAPTMEN1NPC1KDM4E
Acridan SCHEMBL10813635 0.77 MAPT (0.62) KMT2AMAPTMEN1NPC1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115813915-B Application of polysubstituted indoline-2-thioketone compound in preparation of medicine for treating non-alcoholic fatty liver and diabetes 华东师范大学 2025-02-11 CN claimed
CN-115813915-A Application of polysubstituted indoline-2-thioketone compound in preparation of drugs for treating non-alcoholic fatty liver and diabetes 华东师范大学 2023-03-21 CN claimed
CN-113234007-B Synthesis method of 4-indolylthiobutanoic acid derivative 四川轻化工大学 2022-10-25 CN claimed
CN-113234007-A Synthesis method of 4-indolylthiobutyric acid derivative 四川轻化工大学 2021-08-10 CN claimed
US-8609712-B2 Purification of progesterone receptor modulators WYETH LLC (US) 2013-12-17 US claimed
US-20130012702-A1 PURIFICATION OF PROGESTERONE RECEPTOR MODULATORS WYETH LLC (US) 2013-01-10 US claimed
US-8309594-B2 Purification of progesterone receptor modulators WYETH LLC (US) 2012-11-13 US claimed
US-20090143577-A1 PURIFICATION OF PROGESTERONE RECEPTOR MODULATORS WYETH (US) 2009-06-04 US claimed
US-7514466-B2 Purification of progesterone receptor modulators WYETH (US) 2009-04-07 US claimed
EP-1756072-A2 PURIFICATION OF PROGESTERONE RECEPTOR MODULATORS Wyeth (US) 2007-02-28 EP claimed
WO-2005104711-A2 PURIFICATION OF PROGESTERONE RECEPTOR MODULATORS WYETH (US) 2005-11-10 WO claimed
US-20050250766-A1 Purification of progesterone receptor modulators WYETH (US) 2005-11-10 US claimed
US-5556874-A ENZYME INHIBITORS AS ANTICARCINOGENIC AGENTS WARNER LAMBERT COMPANY (US) 1996-09-17 US claimed
JP-H08503450-A 1996-04-16 JP claimed
EP-0654024-A1 2-THIOINDOLES (SELENOINDOLES) AND RELATED DISULFIDES (SELENIDES) WHICH INHIBIT PROTEIN TYROSINE KINASES AND WHICH HAVE ANTITUMOR PROPERTIES WARNER-LAMBERT COMPANY (US) 1995-05-24 EP claimed
WO-1994003427-A1 2-THIOINDOLES (SELENOINDOLES) AND RELATED DISULFIDES (SELENIDES) WHICH INHIBIT PROTEIN TYROSINE KINASES AND WHICH HAVE ANTITUMOR PROPERTIES WARNER-LAMBERT COMPANY (US) 1994-02-17 WO claimed
JP-55007201-A None JP disclosed
CN-120172991-A Preparation method of thiopyrano [2,3-b ] indole compounds 深圳职业技术大学 2025-06-20 CN disclosed
US-4080207-A Radiation-sensitive compositions and photographic elements containing N-(acylhydrazinophenyl) thioamide nucleating agents EASTMAN KODAK COMPANY (US) 1978-03-21 US disclosed
US-4059583-A CARDIAC RATE LOWERING MCNEIL LABORATORIES, INCORPORATED (US) 1977-11-22 US 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-20130012702-A1 PURIFICATION OF PROGESTERONE RECEPTOR MODULATORS PGR, PGRMC1, GNRHR KMT2A 2999/4885MAPT 4392/4885MEN1 2490/4885
US-20090143577-A1 PURIFICATION OF PROGESTERONE RECEPTOR MODULATORS PGR, PGRMC1, GNRHR KMT2A 2999/4885MAPT 4392/4885MEN1 2490/4885
US-20050250766-A1 Purification of progesterone receptor modulators PGR, PGRMC1, PGRMC2 KMT2A 3043/4885MAPT 4433/4885MEN1 2239/4885

“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.