SCHEMBL164133

SCHEMBL164133

Cc1c(C)c2cc3ccccc3cc2c2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.45
TSHR P16473 3/20 0.45
HPGD P15428 3/20 0.45
HIF1A Q16665 2/20 0.45
CYP3A4 P08684 1/20 0.45
MAPK1 P28482 1/20 0.45
CASP1 P29466 1/20 0.45
RAB9A P51151 1/20 0.45
CASP7 P55210 1/20 0.45
ATM Q13315 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CYP1A2 P05177 7/20 0.44
CYP2A6 P11509 6/20 0.44
ALDH1A1 P00352 6/20 0.44
CYP1B1 Q16678 1/20 0.44
NQO1 P15559 1/20 0.43
TDP1 Q9NUW8 2/20 0.42
HPRT1 P00492 3/20 0.42
MAPT P10636 2/20 0.39
TRPM4 Q8TD43 1/20 0.39

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
SCHEMBL29853851 0.90 HSD17B10 (0.54) HSD17B10TSHRHPGDHIF1ACYP3A4
SCHEMBL4644690 0.90 HSD17B10 (0.54) HSD17B10TSHRHPGDHIF1ACYP3A4
SCHEMBL1976533 0.89 CYP2A6 (0.50) HSD17B10TSHRHPGDHIF1ACYP3A4
SCHEMBL28542519 0.87 NQO1 (0.48) HSD17B10TSHRHPGDHIF1ACYP3A4
SCHEMBL4646013 0.85 HSD17B10 (0.50) HSD17B10TSHRHPGDHIF1ACYP3A4
SCHEMBL7501835 0.84 NQO1 (0.46) HSD17B10TSHRHPGDHIF1ACYP3A4
SCHEMBL687284 0.84 NQO1 (0.46) HSD17B10TSHRHPGDHIF1ACYP3A4
SCHEMBL28106127 0.84 CYP1A2 (0.44) HSD17B10TSHRHPGDHIF1ACYP3A4
SCHEMBL4642683 0.84 CYP2A6 (0.50) HSD17B10TSHRHPGDHIF1ACYP3A4
SCHEMBL29853846 0.84 CYP2A6 (0.50) HSD17B10TSHRHPGDHIF1ACYP3A4

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 1532 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115850292-B Novel C-4 substituted coumarin compound and preparation method and application thereof 昆明医科大学 2024-04-12 CN claimed
US-20230131422-A1 LIGHT-ABSORBING EPOXY FILM AND MANUFACTURING METHOD THEREOF Hojeonable Inc. (KR) 2023-04-27 US claimed
CN-115850292-A Novel C-4 substituted coumarin compounds and preparation method and application thereof 昆明医科大学 2023-03-28 CN claimed
CN-114686435-A Preparation method of estrogen receptor positive mouse breast cancer cell strain 中山大学孙逸仙纪念医院 2022-07-01 CN claimed
CN-114271983-A Oral cancer animal model under arecoline background and molding method 中南大学湘雅医院 2022-04-05 CN claimed
US-20190110418-A1 PAPAYA WITH NOVEL TRAITS AND METHODS FOR PRODUCING SUCH PAPAYA PLANTS HORTIGENETICS RESEARCH (S.E. ASIA) LTD. (TH) 2019-04-18 US claimed
CN-106727492-A A kind of application of polymethoxyflavone on the medicine for preparing treatment cutaneous papilloma 黄冈师范学院 2017-05-31 CN claimed
CN-104001151-A Application of caerulin in preparing sensitizing preparation of medicaments for intervening in pancreatic cancer animal model UNIV FUDAN SHANGHAI CANCER CT 2014-08-27 CN claimed
JP-4350148-B2 2009-10-21 JP claimed
EP-1733056-A4 METHOD TO DETERMINE RESPONSIVENESS OF CANCER TO EPIDERMAL GROWTH FACTOR RECEPTOR TARGETING TREATMENTS GEN HOSPITAL CORP (US) 2009-08-12 EP claimed
US-20040053236-A1 Reverse genetic strategy for identifying functional mutations in genes of known sequences NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2004-03-18 US claimed
US-RE38392-E1 Method for identifying metastatic sequences BAYLOR COLLEGE OF MEDICINE 2004-01-20 US claimed
EP-0870057-B1 METHOD FOR IDENTIFYING METASTATIC SEQUENCES BAYLOR COLLEGE MEDICINE (US) 2003-09-24 EP claimed
US-20030003088-A1 Human pancreatic pluripotential stem cell line BOARD OF TRUSTEES OPERATING MICHIGAN STATE UNIVERSITY 2003-01-02 US claimed
WO-2001075167-A1 REVERSE GENETIC STRATEGY FOR IDENTIFYING FUNCTIONAL MUTATIONS IN GENES OF KNOWN SEQUENCE FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2001-10-11 WO claimed
EP-0870057-A2 METHOD FOR IDENTIFYING METASTATIC SEQUENCES THE BAYLOR COLLEGE OF MEDICINE (US) 1998-10-14 EP claimed
US-5783182-A AMPLIFICATION; POLYMERASE CHAIN REACTION; CALIBRATION BAYLOR COLLEGE OF MEDICINE (US) 1998-07-21 US claimed
WO-1997018454-A9 METHOD FOR IDENTIFYING METASTATIC SEQUENCES 1997-07-17 WO claimed
WO-1997018454-A2 METHOD FOR IDENTIFYING METASTATIC SEQUENCES BAYLOR COLLEGE OF MEDICINE (US) 1997-05-22 WO claimed
WO-1994006413-A1 THERAPEUTIC ELEVATED LEVELS OF TRIMETHYLAMINE OXIDE THE BETH ISRAEL HOSPITAL ASSOCIATION (US) 1994-03-31 WO claimed