SCHEMBL31496254

SCHEMBL31496254

Clc1nc(C2CC2)cc2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.45
▸ ALDH1A1 P00352 5/20 0.37
▸ MAPT P10636 3/20 0.37
▸ HPGD P15428 3/20 0.37
▸ TSHR P16473 2/20 0.37
▸ HSD17B10 Q99714 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ PDE4D Q08499 1/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ CYP1B1 Q16678 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ CYP1A2 P05177 2/20 0.33
▸ HTT P42858 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ APEX1 P27695 1/20 0.33
▸ MAPK1 P28482 1/20 0.33

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
SCHEMBL1536289 1.00 POLB (0.45) POLBALDH1A1MAPTHPGDTSHR
SCHEMBL30389934 0.74 POLB (0.42) POLBALDH1A1MAPTHPGDTSHR
SCHEMBL744398 0.74 BTK (0.47) POLBALDH1A1MAPTHPGDTSHR
SCHEMBL742551 0.74 RAB9A (0.39) ALDH1A1HPGDHSD17B10NPSR1PDE4D
SCHEMBL30112542 0.71 CTSK (0.40) POLBKDM4EMEN1KMT2ACYP1B1
SCHEMBL165745 0.71 L3MBTL1 (0.46) ALDH1A1MAPTTSHRHSD17B10KMT2A
SCHEMBL29601221 0.71 L3MBTL1 (0.46) ALDH1A1MAPTTSHRHSD17B10KMT2A
SCHEMBL29118682 0.70 ALDH1A1 (0.44) POLBALDH1A1MAPTHPGDHSD17B10
SCHEMBL31496225 0.70 CHEK1 (0.42) ALDH1A1KDM4EPDE4DL3MBTL1CYP1A2
SCHEMBL31388225 0.69 MEN1 (0.55) ALDH1A1MAPTHPGDTSHRKDM4E

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-2025081092-A1 BIFUNCTIONAL ANDROGEN RECEPTOR COMPOUNDS KOLM THERAPEUTICS INC. (US) 2025-04-17 — — WO disclosed
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