SCHEMBL11765631

SCHEMBL11765631

C/C(=C\CCC(=O)O)CCl

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FNTA P49354 7/20 0.47
FNTB P49356 7/20 0.47
KDM4E B2RXH2 1/20 0.42
ATM Q13315 1/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
TRPA1 O75762 1/20 0.42
TSHR P16473 1/20 0.39
LMNA P02545 1/20 0.39
SLC15A2 Q16348 1/20 0.39
FFAR1 O14842 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP19A1 P11511 1/20 0.38
RXRA P19793 1/20 0.38
PPARG P37231 1/20 0.38
OXER1 Q8TDS5 1/20 0.38
KDM1A O60341 1/20 0.37
POLB P06746 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
SCHEMBL11765636 1.00 FNTA (0.47) FNTAFNTBKDM4EATMKMT2A
SCHEMBL8927123 0.81 FNTA (0.55) FNTAFNTBKDM4EATMKMT2A
SCHEMBL9577320 0.80 KMT2A (0.48) FNTAFNTBKDM4EATMKMT2A
SCHEMBL11228228 0.79 FNTA (0.54) FNTAFNTBKDM4EATMKMT2A
SCHEMBL11228231 0.79 FNTA (0.54) FNTAFNTBKDM4EATMKMT2A
SCHEMBL21176643 0.79 FNTA (0.48) FNTAFNTBKDM4EATMKMT2A
SCHEMBL20840673 0.79 FNTA (0.48) FNTAFNTBKDM4EATMKMT2A
SCHEMBL21176642 0.79 FNTA (0.48) FNTAFNTBKDM4EATMKMT2A
SCHEMBL14150254 0.79 FNTA (0.48) FNTAFNTBKDM4EATMKMT2A
SCHEMBL14150255 0.79 FNTA (0.48) FNTAFNTBKDM4EATMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3932543-A Process for halogenation of conjugated dienes to dihalogenated butene products SCM CORPORATION (US) 1976-01-13 US disclosed