SCHEMBL9806310

SCHEMBL9806310

C=C(c1ccccc1)c1ccccc1Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.53
CYP2D6 P10635 3/20 0.49
CYP2C19 P33261 3/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2C9 P11712 2/20 0.49
BCL2 P10415 1/20 0.45
BCL2L1 Q07817 1/20 0.45
CYP3A4 P08684 2/20 0.44
HTR2A P28223 1/20 0.42
CALM1 P0DP23 1/20 0.42
CAPN1 P07384 1/20 0.42
PTPN1 P18031 1/20 0.41
ALOX5 P09917 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
NFKB1 P19838 1/20 0.39
BLM P54132 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
SCHEMBL9806368 0.82 ALDH1A1 (0.51) TSHRALDH1A1MAPTTDP1SCN1A
SCHEMBL6695693 0.82 TSHR (0.55) TSHRCYP2D6CYP2C19CYP1A2CYP2C9
SCHEMBL9806292 0.81 TSHR (0.56) TSHRCYP2D6CYP2C19CYP1A2CYP2C9
SCHEMBL28259941 0.80 TSHR (0.53) TSHRCYP2D6CYP2C19CYP1A2CYP2C9
SCHEMBL29133683 0.80 TSHR (0.49) TSHRCYP2D6CYP2C19CYP1A2CYP2C9
SCHEMBL6272312 0.80 TSHR (0.62) TSHRCYP2D6CYP2C19CYP1A2CYP2C9
SCHEMBL13101657 0.79 HPGD (0.46) TSHRCYP3A4ALDH1A1MAPTNPSR1
SCHEMBL5694037 0.78 MEN1 (0.48) TSHRCYP2C19CYP3A4ALDH1A1MAPT
SCHEMBL27749938 0.78 DPP4 (0.42) MAPT
SCHEMBL6546180 0.78 MEN1 (0.42) TSHRALDH1A1MAPTNPSR1

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
US-4734824-A MONOOLEFIN OR DIOLEFIN HAVING THREE CONDENSED OR NONCONDENSED AROMATIC RINGS NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-03-29 US claimed
US-4994539-A Ethylene-unsaturated aromatic copolymer NIPPON PETROCHEMICALS CO., LTD. (JP) 1991-02-19 US disclosed
EP-0180771-B1 METHOD FOR IMPROVING IMPULSE BREAKDOWN STRENGTH OF ELECTRICALLY INSULATING MATERIALS Nippon Petrochemicals Co., Ltd. (JP) 1989-08-02 EP disclosed
US-4734824-A MONOOLEFIN OR DIOLEFIN HAVING THREE CONDENSED OR NONCONDENSED AROMATIC RINGS NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-03-29 US disclosed
EP-0154993-B1 ELECTRICAL INSULATING OIL AND ELECTRICAL APPLIANCES IMPREGNATED WITH THE SAME NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-03-09 EP disclosed
US-4621302-A MONO-OR DIOLEFIN HAVING THREE CONDENSED OR NON-CONDENSED AROMATIC RINGS NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1986-11-04 US disclosed
EP-0180771-A1 Method for improving impulse breakdown strength of electrically insulating materials Nippon Petrochemicals Co., Ltd. (JP) 1986-05-14 EP disclosed
EP-0154993-A1 Electrical insulating oil and electrical appliances impregnated with the same NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1985-09-18 EP disclosed