SCHEMBL31444372

SCHEMBL31444372

O=C1CCN(c2ccc(C(=O)O)c(F)c2)C(c2ccccc2Cl)C1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RORC P51449 5/20 0.41
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
PDE5A O76074 1/20 0.39
NR1H4 Q96RI1 3/20 0.36
HDAC6 Q9UBN7 2/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
AHR P35869 1/20 0.35
EGFR P00533 1/20 0.35
CMA1 P23946 2/20 0.35
RIPK1 Q13546 1/20 0.34
FFAR2 O15552 2/20 0.34

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
SCHEMBL31444401 0.88 NR1H4 (0.39) RORCHSP90AA1HSP90AB1PDE5ANR1H4
SCHEMBL31444719 0.79 RORC (0.42) RORCHSP90AA1HSP90AB1PDE5ANR1H4
SCHEMBL31444350 0.79 RORC (0.40) RORCHSP90AA1HSP90AB1PDE5ANR1H4
SCHEMBL31443526 0.78 SCN9A (0.34) RORCHSP90AA1HSP90AB1NR1H4
SCHEMBL31444342 0.78 RORC (0.43) RORCHSP90AA1HSP90AB1PDE5ANR1H4
SCHEMBL31444366 0.75 RORC (0.40) RORCHSP90AA1HSP90AB1PDE5ANR1H4
SCHEMBL31444319 0.70 HPGD (0.39) RORCHSP90AA1PDE5ARIPK1
SCHEMBL31444405 0.68 HSP90AA1 (0.43) HSP90AA1HSP90AB1FFAR2
SCHEMBL31444410 0.68 HSP90AA1 (0.43) HSP90AA1HSP90AB1FFAR2
SCHEMBL31444460 0.66 PDE5A (0.56) HSP90AA1HSP90AB1PDE5AFFAR2

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-2025072451-A1 RAS-PI3K INHIBITORS FOR THE TREATMENT OF CANCER AND IMMUNOLOGICAL DISEASES VIVIDION THERAPEUTICS, INC. (US) 2025-04-03 WO disclosed