SCHEMBL11654414

SCHEMBL11654414

COc1ccc(-c2cc3cc(C)cc(C)c3[nH]2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.53
▸ NPC1 O15118 6/20 0.53
▸ RAB9A P51151 6/20 0.53
▸ MAPT P10636 4/20 0.53
▸ CASP3 P42574 1/20 0.53
▸ SENP8 Q96LD8 1/20 0.53
▸ SENP7 Q9BQF6 1/20 0.53
▸ SENP6 Q9GZR1 1/20 0.53
▸ CCNB2 O95067 2/20 0.48
▸ CDK1 P06493 2/20 0.48
▸ CCNB1 P14635 2/20 0.48
▸ CCNB3 Q8WWL7 2/20 0.48
▸ RIPK1 Q13546 1/20 0.48
▸ ALDH1A1 P00352 5/20 0.46
▸ HPGD P15428 4/20 0.46
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ NPY5R Q15761 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ GSK3A P49840 1/20 0.43

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
SCHEMBL11653533 0.81 KDM4E (0.60) KDM4ENPC1RAB9AMAPTCASP3
SCHEMBL28280284 0.81 KMT2A (0.41) NPC1RAB9AMAPTCCNB2CDK1
SCHEMBL10936827 0.80 NPC1 (0.47) KDM4ENPC1RAB9AMAPTCCNB2
SCHEMBL11657634 0.78 KDM4E (0.53) KDM4ENPC1RAB9AMAPTCASP3
SCHEMBL11651810 0.76 KDM4E (0.67) KDM4ENPC1RAB9AMAPTCASP3
SCHEMBL24108255 0.75 KDM4E (0.53) KDM4ENPC1RAB9AMAPTCASP3
SCHEMBL30411878 0.75 KDM4E (0.53) KDM4ENPC1RAB9AMAPTCASP3
SCHEMBL11659214 0.73 KDM4E (0.67) KDM4ENPC1RAB9AMAPTCASP3
SCHEMBL4769329 0.72 KDM4E (0.59) KDM4ENPC1RAB9AMAPTCASP3
SCHEMBL7945775 0.70 KDM4E (0.73) KDM4ENPC1RAB9AMAPTCASP3

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-4113736-A NONTOXIC POLYMER STABILIZERS S. A. LABAZ (BE) 1978-09-12 — — US disclosed
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