SCHEMBL19998337

SCHEMBL19998337

CCCc1ccc(-c2ccc(-c3ccc(OC)cc3)cc2)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.50
APP P05067 1/20 0.47
CYP2C19 P33261 1/20 0.47
TAAR1 Q96RJ0 1/20 0.42
RARB P10826 1/20 0.42
ALOX5 P09917 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
FFAR1 O14842 2/20 0.41
AKR1C3 P42330 1/20 0.41
AKR1C2 P52895 1/20 0.41
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
MAPT P10636 1/20 0.39
ABL1 P00519 1/20 0.39
ABCB1 P08183 1/20 0.39
BCR P11274 1/20 0.39
MMP12 P39900 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
SCHEMBL21321935 0.98 APP (0.48) MAOBAPPCYP2C19TAAR1RARB
SCHEMBL9664295 0.95 MAOB (0.49) MAOBAPPCYP2C19TAAR1RARB
SCHEMBL9664790 0.95 MAOB (0.49) MAOBAPPCYP2C19TAAR1RARB
SCHEMBL883755 0.93 MAOB (0.53) MAOBAPPCYP2C19TAAR1RARB
SCHEMBL18556626 0.93 MAOB (0.53) MAOBAPPCYP2C19TAAR1RARB
SCHEMBL18468436 0.93 MAOB (0.53) MAOBAPPCYP2C19TAAR1RARB
SCHEMBL21901394 0.90 RARB (0.50) MAOBAPPCYP2C19TAAR1RARB
SCHEMBL3162340 0.89 AKR1C3 (0.46) MAOBAPPCYP2C19TAAR1RARB
SCHEMBL19721819 0.88 RARB (0.55) MAOBAPPCYP2C19RARBCASP3
SCHEMBL10970309 0.88 CYP2C19 (0.49) MAOBAPPCYP2C19RARBFFAR1

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
US-10948780-B2 Liquid crystal element and method of producing the same JSR CORPORATION (JP) 2021-03-16 US disclosed
US-20180086978-A1 LIQUID CRYSTAL ELEMENT AND METHOD OF PRODUCING THE SAME JSR CORPORATION (JP) 2018-03-29 US disclosed
US-20180086978-A1 LIQUID CRYSTAL ELEMENT AND METHOD OF PRODUCING THE SAME JSR CORPORATION (JP) 2018-03-29 US disclosed