SCHEMBL31616441

SCHEMBL31616441

Clc1ccc2[nH]c3cccc(-c4ccccc4)c3c2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.59
▸ KMT2A Q03164 5/20 0.59
▸ RXFP1 Q9HBX9 1/20 0.59
▸ CDK4 P11802 1/20 0.52
▸ CCND1 P24385 1/20 0.52
▸ ALDH1A1 P00352 4/20 0.50
▸ KDM4E B2RXH2 4/20 0.48
▸ MAP2 P11137 3/20 0.48
▸ CASP1 P29466 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ MAPK1 P28482 2/20 0.47
▸ CA1 P00915 1/20 0.47
▸ CA2 P00918 1/20 0.47
▸ ROCK2 O75116 1/20 0.47
▸ MAP4K4 O95819 1/20 0.47
▸ LCK P06239 1/20 0.47
▸ CSF1R P07333 1/20 0.47
▸ PIM1 P11309 1/20 0.47
▸ RPS6KB1 P23443 1/20 0.47

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
SCHEMBL19998222 1.00 MEN1 (0.59) MEN1KMT2ARXFP1CDK4CCND1
SCHEMBL19998253 0.97 MEN1 (0.56) MEN1KMT2ARXFP1CDK4CCND1
SCHEMBL26203484 0.94 MEN1 (0.56) MEN1KMT2ARXFP1CDK4CCND1
SCHEMBL25583631 0.93 MEN1 (0.51) MEN1KMT2ARXFP1CDK4CCND1
SCHEMBL26191621 0.88 ALDH1A1 (0.50) MEN1KMT2ARXFP1CDK4CCND1
SCHEMBL19998255 0.85 KMT2A (0.43) MEN1KMT2ARXFP1CDK4CCND1
SCHEMBL19494764 0.84 CDK4 (0.56) MEN1KMT2ACDK4CCND1MAPK1
SCHEMBL31664385 0.81 IMPDH2 (0.55) CDK4CCND1ALDH1A1KDM4EHSD17B10
SCHEMBL1177888 0.81 IMPDH2 (0.55) CDK4CCND1ALDH1A1KDM4EHSD17B10
SCHEMBL24765750 0.81 CDK4 (0.52) RXFP1CDK4CCND1ALDH1A1KDM4E

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-2025118727-A1 NITROGEN-CONTAINING COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC APPARATUS 陕西莱特光电材料股份有限公司 2025-06-12 — — WO disclosed
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