SCHEMBL8385488

SCHEMBL8385488

C=CCCC/C=C(\C)CCCCCCCCCCC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.56
ALDH1A1 P00352 2/20 0.48
LSS P48449 2/20 0.41
FAAH O00519 1/20 0.41
MAPT P10636 2/20 0.39
ABCC4 O15439 1/20 0.39
LMNA P02545 2/20 0.39
SQLE Q14534 1/20 0.39
EP300 Q09472 1/20 0.37
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
TERT O14746 2/20 0.36
GMNN O75496 1/20 0.36
USP2 O75604 1/20 0.36
CYP1A2 P05177 1/20 0.36
POLB P06746 1/20 0.36
CYP2C9 P11712 1/20 0.36
ALOX15 P16050 1/20 0.36
APEX1 P27695 1/20 0.36

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
SCHEMBL8385489 1.00 TSHR (0.56) TSHRALDH1A1LSSFAAHMAPT
SCHEMBL29284415 0.96 TSHR (0.61) TSHRALDH1A1LSSFAAHMAPT
SCHEMBL29284458 0.92 TSHR (0.56) TSHRALDH1A1LSSFAAHMAPT
SCHEMBL29284196 0.92 TSHR (0.56) TSHRALDH1A1LSSFAAHMAPT
SCHEMBL995861 0.92 TSHR (0.61) TSHRALDH1A1LSSFAAHMAPT
SCHEMBL29284307 0.92 TSHR (0.56) TSHRALDH1A1LSSFAAHMAPT
SCHEMBL999077 0.90 TSHR (0.64) TSHRALDH1A1LSSFAAHMAPT
SCHEMBL29284342 0.90 TSHR (0.56) TSHRALDH1A1LSSFAAHMAPT
SCHEMBL1136744 0.88 TSHR (0.58) TSHRALDH1A1LSSMAPTABCC4
SCHEMBL1136745 0.88 TSHR (0.58) TSHRALDH1A1LSSMAPTABCC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0570824-B1 Process for selective reduction of unsaturated organic compounds GOODYEAR TIRE & RUBBER (US) 1999-04-14 EP disclosed
EP-0570824-A2 Process for selective reduction of unsaturated organic compounds THE GOODYEAR TIRE & RUBBER COMPANY (US) 1993-11-24 EP disclosed
US-5254761-A Using mixture of hydrazine and oxidizer THE GOODYEAR TIRE & RUBBER COMPANY (US) 1993-10-19 US disclosed