SCHEMBL30736499

SCHEMBL30736499

Cc1[nH]c2cccc(F)c2c1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 2/20 0.43
TUBB P07437 2/20 0.43
TUBA3C P0DPH7 2/20 0.43
TUBA1B P68363 2/20 0.43
TUBA4A P68366 2/20 0.43
TUBB4B P68371 2/20 0.43
TUBB3 Q13509 2/20 0.43
TUBB2A Q13885 2/20 0.43
TUBB8 Q3ZCM7 2/20 0.43
TUBA3E Q6PEY2 2/20 0.43
TUBA1A Q71U36 2/20 0.43
TUBA1C Q9BQE3 2/20 0.43
TUBB6 Q9BUF5 2/20 0.43
TUBB2B Q9BVA1 2/20 0.43
TUBB1 Q9H4B7 2/20 0.43
IMPDH2 P12268 1/20 0.42
MAPT P10636 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL28191294 0.82 IMPDH2 (0.45) IMPDH2MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL28435895 0.81 CDK4 (0.47) IMPDH2LMNAPDGFRAMAPK8CDK5
SCHEMBL11255967 0.79 IMPDH2 (0.49) IMPDH2MAPTLMNAPDGFRAMAPK8
SCHEMBL5390122 0.72 TTR (0.58) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL17383846 0.72 IMPDH2 (0.73) IMPDH2MAPTMEN1KMT2ALMNA
SCHEMBL28016595 0.71 CNR1 (0.50) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL7271179 0.71 TUBB4A (0.45) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL15193380 0.71 MAPT (0.60) MAPTPADI4
Hydrochloric Acid SCHEMBL30833257 0.70 TTR (0.56) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL12836459 0.70 FEN1 (0.52) IMPDH2CNR1FEN1ALDH1A1

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
WO-2024050433-A1 ALLOSTERIC MODULATORS OF ANDROGEN RECEPTOR COACTIVATOR RECRUITMENT FOR CRPC THERAPY UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2024-03-07 WO claimed