SCHEMBL6911079

SCHEMBL6911079

CC(C)Cc1ccc2c(c1)C=CC2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
POLB P06746 2/20 0.33
MAPT P10636 2/20 0.33
PTGS2 P35354 4/20 0.33
PTGS1 P23219 3/20 0.33
LMNA P02545 3/20 0.33
CYP2C9 P11712 3/20 0.33
ESR1 P03372 3/20 0.33
AKR1C3 P42330 2/20 0.33
CXCR1 P25024 2/20 0.33
CXCR2 P25025 2/20 0.33
ALOX5 P09917 2/20 0.33
NFKB1 P19838 2/20 0.33
HTR2A P28223 2/20 0.33
BLM P54132 2/20 0.33
PMP22 Q01453 2/20 0.33
ALB P02768 1/20 0.33

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
SCHEMBL6911871 0.86 GABRA1 (0.41) GABRA1GABRB2MEN1KMT2APOLB
SCHEMBL6904988 0.79 TRPA1 (0.38) MAPTLMNAHTR2AKDM4EALDH1A1
SCHEMBL7193247 0.79 CA2 (0.33) MEN1KMT2APOLBMAPTESR1
SCHEMBL7182926 0.79 CA1 (0.32)
SCHEMBL6914459 0.76 CNR1 (0.40) ALOX5HTR2ACNR1HTR2B
SCHEMBL14945676 0.76 CA1 (0.31)
SCHEMBL21694437 0.76 HRH3 (0.34)
SCHEMBL14956431 0.74 TSHR (0.32) TSHR
SCHEMBL6913089 0.74 SKP2 (0.42) PTGS2PTGS1LMNACYP2C9ESR1
SCHEMBL22952617 0.74 GABRA1 (0.40) GABRA1GABRB2MEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112105654-A Curable resin mixture, curable resin composition, and cured product thereof 日本化药株式会社 2020-12-18 CN disclosed
WO-2020031935-A1 CURABLE RESIN MIXTURE, CURABLE RESIN COMPOSITION, AND CURED PRODUCT 日本化薬株式会社 2020-02-13 WO disclosed
CN-1189435-C Novel transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO LTD (JP) 2005-02-16 CN disclosed
EP-0969010-B1 Transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO LTD (JP) 2004-09-22 EP disclosed
US-6352953-B1 TRANSITION METAL COMPLEX HAVING 5-MEMBERED RING FORMED BY TRANSITION METAL COMPOUND OF GROUP IVB, TWO CARBONS, METAL OF GROUP IIIA AND HYDROGEN JAPAN POLYOLEFINS CO., LTD. (JP) 2002-03-05 US disclosed
US-6150544-A Transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO., LTD. (JP) 2000-11-21 US disclosed
CN-1240782-A Novel transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO LTD (JP) 2000-01-12 CN disclosed
EP-0969010-A2 Transition metal compound and catalyst containing the same for polymerization of olefins Japan Polyolefins Co., Ltd. (JP) 2000-01-05 EP disclosed