SCHEMBL7861886

SCHEMBL7861886

Cc1c(Cc2ccccc2)cccc1Cc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.52
HTR2A P28223 1/20 0.50
BCL2 P10415 1/20 0.48
BCL2L1 Q07817 1/20 0.48
CYP3A4 P08684 2/20 0.44
CYP2D6 P10635 2/20 0.44
CYP2C19 P33261 2/20 0.44
CNR2 P34972 1/20 0.44
GPR55 Q9Y2T6 1/20 0.44
MEN1 O00255 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
MAPT P10636 1/20 0.43
MAPK1 P28482 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
DRD2 P14416 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
SCHEMBL6546124 0.91 TP53 (0.46) CALM1HTR2ABCL2BCL2L1CYP3A4
SCHEMBL1276090 0.91 CALM1 (0.48) CALM1HTR2ABCL2BCL2L1CYP3A4
SCHEMBL27313616 0.89 PDCD1 (0.58) CALM1HTR2ABCL2BCL2L1CYP3A4
Ammonia Solution, Strong SCHEMBL27502158 0.89 CALM1 (0.46) CALM1HTR2ABCL2BCL2L1CYP3A4
SCHEMBL8098213 0.87 CALM1 (0.55) CALM1HTR2ABCL2BCL2L1CNR2
Chloromethane SCHEMBL27508976 0.87 CALM1 (0.44) CALM1HTR2ABCL2BCL2L1CYP3A4
SCHEMBL11208418 0.87 HTR2A (0.48) CALM1HTR2ABCL2BCL2L1CYP3A4
Hydrochloric Acid SCHEMBL28173092 0.87 CALM1 (0.44) CALM1HTR2ABCL2BCL2L1CYP3A4
SCHEMBL6548102 0.86 GABRA1 (0.47) CALM1HTR2ABCL2BCL2L1CNR2
SCHEMBL10891857 0.85 CYP3A4 (0.50) CALM1HTR2ABCL2BCL2L1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0953194-B1 ELECTRIC CABLE NKT CABLES AS (DK) 2001-05-16 EP claimed
EP-0953194-A1 ELECTRIC CABLE NKT Cables A/S (DK) 1999-11-03 EP claimed
WO-1998032137-A1 ELECTRIC CABLE NKT CABLES A/S (DK) 1998-07-23 WO claimed
US-10359409-B2 Method for measuring a degree of hydrogenation Friedrich-Alexander-Universität Erlangen-Nürnberg (DE) 2019-07-23 US disclosed
EP-3218711-B1 METHOD AND DEVICE FOR MEASURING THE HYDROGENATION LEVEL OF A LIQUID ORGANIC HYDROGEN CARRIER UNIV FRIEDRICH ALEXANDER ER (DE) 2019-06-19 EP disclosed
US-20170322192-A1 METHOD FOR MEASURING A DEGREE OF HYDROGENATION HYDROGENIOUS LOHC TECHNOLOGIES GMBH (DE) 2017-11-09 US disclosed
EP-3218711-A1 METHOD AND DEVICE FOR MEASURING THE HYDROGENATION LEVEL OF A LIQUID ORGANIC HYDROGEN CARRIER Friedrich-Alexander-Universität Erlangen-Nürnberg (DE) 2017-09-20 EP disclosed
WO-2016075077-A1 METHOD AND DEVICE FOR MEASURING THE HYDROGENATION LEVEL OF A LIQUID ORGANIC HYDROGEN CARRIER Friedrich-Alexander-Universität Erlangen-Nürnberg (DE) 2016-05-19 WO disclosed
EP-0953194-B1 ELECTRIC CABLE NKT CABLES AS (DK) 2001-05-16 EP disclosed
EP-0953194-A1 ELECTRIC CABLE NKT Cables A/S (DK) 1999-11-03 EP disclosed
WO-1998032137-A1 ELECTRIC CABLE NKT CABLES A/S (DK) 1998-07-23 WO disclosed
EP-0176366-B1 IMPREGNATED CAPACITOR NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-01-25 EP disclosed
US-4631632-A METALLIZED POLYPROPYLENE FILM IMPREGNATED WITH DIELECTRIC HAVING THREE CONDENSED OR NONCONDENSED AROMATIC RINGS NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1986-12-23 US disclosed
EP-0176366-A2 Impregnated capacitor NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1986-04-02 EP disclosed
US-4523044-A FREE RADICAL OLIGOMERIZATION OF TOLUENE WITH CHLORIDE ATOCHEM (FR) 1985-06-11 US disclosed
EP-0136230-A1 Compositions of oligomers of polyaryl alkanes, and process for their preparation ELF ATOCHEM S.A. (FR) 1985-04-03 EP disclosed
US-4214108-A TITANIUM HALIDE AND ALKYLALUMINUM HALIDE CATALYST CHEMISCHE WERKE HULS AKTIENGESELLSCHAFT (DE) 1980-07-22 US disclosed