SCHEMBL9700124

SCHEMBL9700124

CNC1C(C)Oc2cc(OC)cc3c(Sc4ccccc4)c(C)n1c23

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35
TUBB8 Q3ZCM7 1/20 0.35
TUBA3E Q6PEY2 1/20 0.35
TUBA1A Q71U36 1/20 0.35
TUBA1C Q9BQE3 1/20 0.35
TUBB6 Q9BUF5 1/20 0.35
TUBB2B Q9BVA1 1/20 0.35
TUBB1 Q9H4B7 1/20 0.35
MAPT P10636 3/20 0.32
AKR1B1 P15121 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31
EDNRA P25101 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL9700074 0.76 TUBB4A (0.33) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL9700412 0.73 DRD2 (0.33) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL9700330 0.71 CNR1 (0.40) MAPTTP53
SCHEMBL9701551 0.71 CNR1 (0.40) MAPTTP53
SCHEMBL9699362 0.70 CNR1 (0.39) MAPTTP53
SCHEMBL9701364 0.69 CNR1 (0.38) MAPTTP53
SCHEMBL9700401 0.67 CNR1 (0.36) MAPTTP53
SCHEMBL9700394 0.66 TUBB4A (0.30) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL9701576 0.61 PTGDR2 (0.33) MAPTAKR1B1PTGDR2
SCHEMBL9700286 0.58 PTGDR2 (0.34) MAPTAKR1B1PTGDR2

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-5112820-A Vision defects STERLING DRUG INC. (US) 1992-05-12 US disclosed