SCHEMBL31746966

SCHEMBL31746966

Cn1ncc2cc(Nc3cccc4ccn(CC(=O)Nc5cccc(C(C)(C)O)c5)c(=O)c34)cnc21

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 3/20 0.40
NLRP3 Q96P20 1/20 0.40
MAPT P10636 3/20 0.37
LMNA P02545 3/20 0.37
TP53 P04637 1/20 0.37
THRB P10828 1/20 0.37
POLB P06746 3/20 0.36
ALDH1A1 P00352 2/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
FSCN1 Q16658 1/20 0.35
IRAK4 Q9NWZ3 1/20 0.35
NOTUM Q6P988 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL25073805 1.00 RXFP1 (0.40) RXFP1NLRP3MAPTLMNATP53
SCHEMBL25073877 0.89 NOTUM (0.42) RXFP1NLRP3MAPTLMNAPOLB
SCHEMBL30279170 0.89 NOTUM (0.42) RXFP1NLRP3MAPTLMNAPOLB
SCHEMBL31162540 0.88 RXFP1 (0.47) RXFP1NLRP3MAPTLMNAPOLB
SCHEMBL31746937 0.87 NLRP3 (0.41) RXFP1NLRP3MAPTLMNATP53
SCHEMBL25073770 0.87 NLRP3 (0.41) RXFP1NLRP3MAPTLMNATP53
SCHEMBL25073881 0.86 RXFP1 (0.41) RXFP1NLRP3MAPTLMNATP53
SCHEMBL31746957 0.86 RXFP1 (0.41) RXFP1NLRP3MAPTLMNATP53
SCHEMBL25073879 0.86 NLRP3 (0.37) RXFP1NLRP3LMNATP53POLB
SCHEMBL31746919 0.86 NLRP3 (0.37) RXFP1NLRP3LMNATP53POLB

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