SCHEMBL9619331

SCHEMBL9619331

COc1ccc(-c2cc(SC)cc(-c3ccc(OC)cc3)n2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.54
MAPT P10636 5/20 0.54
ALDH1A1 P00352 4/20 0.54
HPGD P15428 2/20 0.54
NPSR1 Q6W5P4 1/20 0.54
RXFP1 Q9HBX9 1/20 0.54
NPC1 O15118 7/20 0.53
RAB9A P51151 7/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
DYRK1A Q13627 1/20 0.53
PKM P14618 1/20 0.53
CASP3 P42574 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ACACA Q13085 1/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
EGFR P00533 1/20 0.47
KDR P35968 1/20 0.47

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
SCHEMBL7859483 0.80 ADORA3 (0.61) KDM4EMAPTALDH1A1HPGDNPC1
SCHEMBL9704213 0.79 EGFR (0.60) KDM4EMAPTALDH1A1HPGDNPC1
SCHEMBL9619544 0.77 NPC1 (0.43) KDM4EMAPTALDH1A1HPGDNPC1
SCHEMBL9619520 0.76 MEN1 (0.50) KDM4EMAPTALDH1A1HPGDRAB9A
SCHEMBL5593018 0.76 ACACA (0.57) KDM4EMAPTALDH1A1HPGDNPSR1
SCHEMBL16146442 0.76 CYP1A1 (0.67) KDM4EMAPTALDH1A1NPC1RAB9A
SCHEMBL8271638 0.76 ACACA (0.66) KDM4EMAPTALDH1A1HPGDNPSR1
SCHEMBL27740718 0.75 DYRK1A (0.67) KDM4EMAPTALDH1A1HPGDNPSR1
SCHEMBL12306221 0.75 ADORA3 (0.59) KDM4EMAPTALDH1A1HPGDNPC1
SCHEMBL3237986 0.75 EGFR (0.60) KDM4EMAPTALDH1A1HPGDNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0463492-A1 2,6-Diarylpyridin derivatives BAYER AG (DE) 1992-01-02 EP claimed
EP-0263958-B1 4-SUBSTITUTED-2,6-DIPHENYLPYRIDINE DERIVATIVES, USE THEREOF, PRODUCTION OF THE SAME, CHEMICAL INTERMEDIATES THEREIN AND HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-01-22 EP disclosed
EP-0463492-A1 2,6-Diarylpyridin derivatives BAYER AG (DE) 1992-01-02 EP disclosed
US-4849011-A 4-substituted-2,6-diphenylpyridine compounds and herbicide containing the same as an active ingredient SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1989-07-18 US disclosed