SCHEMBL8667216

SCHEMBL8667216

CCCCCCCCCCCCNC(CC)CCCC=O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
EPHX1 P07099 4/20 0.47
ADH1B P00325 3/20 0.47
ADH1C P00326 3/20 0.47
ADH1A P07327 3/20 0.47
ADH7 P40394 3/20 0.47
ADH4 P08319 2/20 0.47
FAAH O00519 2/20 0.46
TRPV1 Q8NER1 2/20 0.46
PPARA Q07869 2/20 0.37
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL2496264 0.88 TSHR (0.47) TSHREPHX1ADH1BADH1CADH1A
SCHEMBL9541689 0.83 EPHX1 (0.48) TSHREPHX1ADH1BADH1CADH1A
SCHEMBL14625028 0.83 EPHX1 (0.48) TSHREPHX1ADH1BADH1CADH1A
SCHEMBL9208917 0.83 EPHX1 (0.48) TSHREPHX1ADH1BADH1CADH1A
SCHEMBL11699658 0.83 EPHX1 (0.48) TSHREPHX1ADH1BADH1CADH1A
SCHEMBL24353239 0.83 EPHX1 (0.48) TSHREPHX1ADH1BADH1CADH1A
SCHEMBL9204346 0.83 EPHX1 (0.48) TSHREPHX1ADH1BADH1CADH1A
SCHEMBL9212478 0.83 EPHX1 (0.48) TSHREPHX1ADH1BADH1CADH1A
SCHEMBL27800763 0.83 EPHX1 (0.48) TSHREPHX1ADH1BADH1CADH1A
SCHEMBL9206251 0.83 EPHX1 (0.48) TSHREPHX1ADH1BADH1CADH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4614771-A POLYMERIZATION WITH AROMATIC VINYL MONOMER AND ALKALINE(OR ALKALINE EARTH) METAL, THEN MINO(OR AMINOTHIO)ALDEHYDES OR KETONES NIPPON ZEON CO., LTD. (JP) 1986-09-30 US claimed
EP-0572792-B1 Tire tread composition BRIDGESTONE CORP (JP) 1998-12-09 EP disclosed
EP-0572792-A1 Tire tread composition BRIDGESTONE CORPORATION (JP) 1993-12-08 EP disclosed
US-5248722-A Functionalized elastomer, oxidized carbon black, reduced hysteresis BRIDGESTONE CORPORATION (JP) 1993-09-28 US disclosed
EP-0180853-B1 PROCESS FOR MAKING DIENE COPOLYMER RUBBERS NIPPON ZEON CO., LTD. (JP) 1989-10-04 EP disclosed
EP-0180141-B1 PROCESS FOR MAKING DIENE POLYMER RUBBERS NIPPON ZEON CO., LTD. (JP) 1989-08-30 EP disclosed
US-4616069-A REACTING THE ALKALI METAL OR ALKALINE EARTH METAL TERMINATED POLYMER WITH TIN COMPOUND AND ORGANIC COMPOUND HAVING AMIDE OR THIOAMIDE LINKAGES NIPPON ZEON CO., LTD. (JP) 1986-10-07 US disclosed
US-4614771-A POLYMERIZATION WITH AROMATIC VINYL MONOMER AND ALKALINE(OR ALKALINE EARTH) METAL, THEN MINO(OR AMINOTHIO)ALDEHYDES OR KETONES NIPPON ZEON CO., LTD. (JP) 1986-09-30 US disclosed
EP-0180853-A1 Process for making diene copolymer rubbers NIPPON ZEON CO., LTD. (JP) 1986-05-14 EP disclosed
EP-0180141-A1 Process for making diene polymer rubbers NIPPON ZEON CO., LTD. (JP) 1986-05-07 EP disclosed