SCHEMBL30954885

SCHEMBL30954885

[2H]C([2H])([2H])Oc1nc(Cl)nc(C)c1F

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.31

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
SCHEMBL12599936 1.00 CYP1A2 (0.31) CYP1A2
SCHEMBL12599922 0.86 CYP1A2 (0.41) CYP1A2
SCHEMBL1586151 0.73 ALDH1A1 (0.41)
SCHEMBL7997044 0.73 KDM4E (0.33) CYP1A2
SCHEMBL12599750 0.72 CYP1A2 (0.47) CYP1A2
SCHEMBL30954864 0.68 ALDH1A1 (0.35)
SCHEMBL30166648 0.68 ALDH1A1 (0.35)
SCHEMBL12599932 0.68 ALDH1A1 (0.35)
SCHEMBL31196790 0.67 CYP1A2 (0.30) CYP1A2
SCHEMBL31492957 0.65 L3MBTL1 (0.53)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4635949-A1 SUBSTITUTED TETRAHYDROCYCLOPENTYL[C]PYRROLE DERIVATIVE, PREPARATION METHOD, INTERMEDIATE AND USE THEREOF Jiangsu NHWA Pharmaceutical Co., Ltd (CN) 2025-10-22 EP disclosed
WO-2024125395-A1 SUBSTITUTED TETRAHYDROCYCLOPENTYL[C]PYRROLE DERIVATIVE, PREPARATION METHOD, INTERMEDIATE AND USE THEREOF 江苏恩华药业股份有限公司 2024-06-20 WO disclosed