SCHEMBL131955

SCHEMBL131955

Cc1c(Cc2c(C(C)(C)C)cc(O)cc2C(C)(C)C)c(C)c(Cc2c(C(C)(C)C)cc(O)cc2C(C)(C)C)c(C)c1Cc1c(C(C)(C)C)cc(O)cc1C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 6/20 0.50
CYP2C19 P33261 6/20 0.50
SMN1; SMN2 Q16637 5/20 0.50
HIF1A Q16665 5/20 0.50
TP53 P04637 3/20 0.50
ALDH1A1 P00352 6/20 0.42
ALOX15 P16050 5/20 0.42
LMNA P02545 5/20 0.42
TYR P14679 2/20 0.42
HSD17B10 Q99714 2/20 0.42
NR1I2 O75469 1/20 0.42
MIF P14174 1/20 0.42
HTT P42858 1/20 0.42
NFE2L2 Q16236 1/20 0.42
HSPA5 P11021 2/20 0.41
CA2 P00918 3/20 0.40
POLB P06746 1/20 0.40
CYP1A2 P05177 4/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 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
SCHEMBL68860 0.91 CYP2C9 (0.48) CYP2C9CYP2C19SMN1; SMN2HIF1ATP53
SCHEMBL10891430 0.83 CYP2C9 (0.46) CYP2C9CYP2C19SMN1; SMN2HIF1ATP53
SCHEMBL2992706 0.78 TP53 (0.34) CYP2C9CYP2C19SMN1; SMN2HIF1ATP53
SCHEMBL105825 0.77 ALDH1A1 (0.52) CYP2C9CYP2C19SMN1; SMN2HIF1ATP53
SCHEMBL9007185 0.76 LMNA (0.48) CYP2C9SMN1; SMN2ALDH1A1ALOX15LMNA
SCHEMBL12620451 0.76 ALDH1A1 (0.52) CYP2C9CYP2C19SMN1; SMN2HIF1ATP53
SCHEMBL8518795 0.76 CYP2C9 (0.40) CYP2C9CYP2C19SMN1; SMN2HIF1ATP53
SCHEMBL2679857 0.76 ALDH1A1 (0.46) CYP2C9CYP2C19SMN1; SMN2HIF1ATP53
SCHEMBL27877808 0.76 ALDH1A1 (0.46) CYP2C9CYP2C19SMN1; SMN2HIF1ATP53
SCHEMBL31332412 0.75 HSPA5 (0.50) CYP2C9CYP2C19SMN1; SMN2HIF1ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230095196-A1 COLOR-STABLE CURING AGENT COMPOSITIONS COMPRISING WATER-DISPERSIBLE POLYISOCYANATES BASF SE (DE) 2023-03-30 US claimed
US-20220387290-A1 SUNSCREEN COMPOSITIONS AND METHOD OF USE THEREOF ISP INVESTMENTS LLC (US) 2022-12-08 US claimed
EP-4097157-A1 COLOR-STABLE CURING AGENT COMPOSITIONS COMPRISING WATER-DISPERSIBLE POLYISOCYANATES BASF SE (DE) 2022-12-07 EP claimed
US-20220306835-A1 METHOD FOR PREPARING POLYISOCYANATE COMPOSITION Hanwha Solutions Corporation (KR) 2022-09-29 US claimed
US-20220125701-A1 SKIN CARE COMPOSITIONS COMPRISING A TERPOLYMER, PROCESS FOR PREPARING THE SAME AND METHOD OF USE THEREOF ISP INVESTMENTS LLC (US) 2022-04-28 US claimed
US-20210338539-A1 LAMELLAR GEL BASED PERSONAL CARE COMPOSITIONS, PROCESS FOR PREPARING THE SAME AND METHOD OF USE THEREOF ISP INVESTMENTS LLC 2021-11-04 US claimed
US-11117995-B2 Process for preparing high melt strength polypropylene FORMOSA PLASTICS CORPORATION, U.S.A. (US) 2021-09-14 US claimed
WO-2021151774-A1 COLOR-STABLE CURING AGENT COMPOSITIONS COMPRISING WATER-DISPERSIBLE POLYISOCYANATES BASF SE (DE) 2021-08-05 WO claimed
US-11001730-B2 Colour-stable curing compositions containing polyisocyanates of (cyclo)aliphatic diisocyanates BASF SE 2021-05-11 US claimed
EP-2771376-B1 COLOUR-STABLE CURING COMPOSITIONS CONTAINING POLYISOCYANATES OF (CYCLO)ALIPHATIC DIISOCYANATES BASF SE (DE) 2021-02-24 EP claimed
EP-3438199-A1 POLYACETAL RESIN COMPOSITION AND MOLDED ARTICLE THEREFROM Mitsubishi Gas Chemical Company, Inc. (JP) 2019-02-06 EP claimed
WO-2018175836-A1 SKIN CARE COMPOSITIONS COMPRISING A TERPOLYMER, PROCESS FOR PREPARING THE SAME AND METHOD OF USE THEREOF ISP INVESTMENTS LLC (US) 2018-09-27 WO claimed
US-20170165187-A1 OIL-IN -WATER EMULSION SUNSCREEN COMPOSITION ISP INVESTMENTS INC. (US) 2017-06-15 US claimed
EP-3099284-A1 OIL-IN-WATER EMULSION SUNSCREEN COMPOSITION ISP Investments Inc. (US) 2016-12-07 EP claimed
WO-2015116899-A1 OIL-IN -WATER EMULSION SUNSCREEN COMPOSITION ISP INVESTMENTS INC. (US) 2015-08-06 WO claimed
EP-2771376-A1 COLOUR-STABLE CURING COMPOSITIONS CONTAINING POLYISOCYANATES OF (CYCLO)ALIPHATIC DIISOCYANATES BASF SE (DE) 2014-09-03 EP claimed
US-8673272-B2 Ultraviolet-absorbing compounds ISP INVESTMENTS INC. (US) 2014-03-18 US claimed
EP-1692222-B1 STABILIZED POLYETHYLENE MATERIAL DOW GLOBAL TECHNOLOGIES LLC (US) 2013-07-03 EP claimed
WO-2013060614-A1 COLOUR-STABLE CURING COMPOSITIONS CONTAINING POLYISOCYANATES OF (CYCLO)ALIPHATIC DIISOCYANATES BASF SE (DE) 2013-05-02 WO claimed
US-20110144246-A1 BLENDS OF STABILIZERS FOR ALIPHATIC POLYESTERS BASF SE (DE) 2011-06-16 US claimed