SCHEMBL11932055

SCHEMBL11932055

CCc1ccc(C(C)(F)F)cc1CN

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 3/20 0.38
▸ ESR2 Q92731 3/20 0.38
▸ CNR1 P21554 1/20 0.35
▸ CNR2 P34972 1/20 0.35
▸ MPO P05164 1/20 0.34
▸ TPO P07202 1/20 0.34
▸ KIF11 P52732 2/20 0.34
▸ TAS1R3 Q7RTX0 1/20 0.33
▸ TAS1R1 Q7RTX1 1/20 0.33
▸ HSD11B1 P28845 1/20 0.32
▸ IDO1 P14902 2/20 0.31
▸ EPHX2 P34913 1/20 0.31
▸ NR1H4 Q96RI1 1/20 0.31
▸ KLF10 Q13118 1/20 0.31
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30

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
SCHEMBL18934899 0.87 MPO (0.43) ESR1ESR2MPOTPOKIF11
SCHEMBL24196658 0.81 DAO (0.36) ESR1CNR1CNR2IDO1EPHX2
SCHEMBL11932057 0.81 ALDH1A1 (0.38) ESR1ESR2KIF11TAS1R3TAS1R1
SCHEMBL24196148 0.79 IDO1 (0.46) KIF11IDO1EPHX2NR1H4
SCHEMBL18266405 0.79 IDO1 (0.46) CNR1CNR2IDO1KLF10
SCHEMBL20811730 0.79 DAO (0.40) ESR1ESR2KIF11TAS1R3TAS1R1
SCHEMBL18266605 0.78 PNMT (0.41) CNR1CNR2KIF11EPHX2NR1H4
SCHEMBL26939102 0.77 KIF11 (0.45) ESR1ESR2KIF11TAS1R3TAS1R1
SCHEMBL24987667 0.76 EPHX2 (0.42) ESR1ESR2EPHX2NR1H4CYP2C19
SCHEMBL29307386 0.76 ESR1 (0.47) ESR1ESR2TAS1R3TAS1R1HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8212433-B2 Electret and electrostatic induction conversion device ASAHI GLASS COMPANY, LIMITED (JP) 2012-07-03 — — US disclosed
US-20110012438-A1 ELECTRET AND ELECTROSTATIC INDUCTION CONVERSION DEVICE ASAHI GLASS COMPANY, LIMITED 2011-01-20 — — US disclosed
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