SCHEMBL31746969

SCHEMBL31746969

O=C(Cn1ccc2cccc(Nc3ccc4[nH]ncc4c3)c2c1=O)Nc1cccc(C(F)(F)F)c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
JAK3 P52333 1/20 0.46
RXFP1 Q9HBX9 2/20 0.44
LMNA P02545 3/20 0.44
RECQL P46063 1/20 0.44
MAPT P10636 4/20 0.43
ROCK1 Q13464 3/20 0.43
TP53 P04637 2/20 0.42
THRB P10828 1/20 0.42
ROCK2 O75116 2/20 0.42
TRPV1 Q8NER1 2/20 0.41
NLRP3 Q96P20 1/20 0.41

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
SCHEMBL25073867 1.00 POLB (0.54) POLBMEN1KMT2AJAK3RXFP1
SCHEMBL25073828 0.90 RXFP1 (0.47) POLBMEN1KMT2ARXFP1LMNA
SCHEMBL30279189 0.85 DDR1 (0.44) POLBMEN1KMT2AROCK1ROCK2
SCHEMBL25073840 0.85 DDR1 (0.44) POLBMEN1KMT2AROCK1ROCK2
SCHEMBL25073769 0.84 KDR (0.45) POLBKMT2AJAK3RXFP1LMNA
SCHEMBL31746908 0.84 KDR (0.45) POLBKMT2AJAK3RXFP1LMNA
SCHEMBL31746947 0.83 RXFP1 (0.47) POLBRXFP1LMNARECQLMAPT
SCHEMBL25073887 0.83 RXFP1 (0.47) POLBRXFP1LMNARECQLMAPT
SCHEMBL31746936 0.82 TAS2R14 (0.40) POLBMEN1KMT2ARXFP1LMNA
SCHEMBL25073832 0.82 TAS2R14 (0.40) POLBMEN1KMT2ARXFP1LMNA

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
EP-4387963-B1 PHENYL- AND PYRIDOPYRAZOLE DERIVATIVES AS INHIBITORS OF DDR1 REDX PHARMA LTD (GB) 2025-12-24 EP disclosed