SCHEMBL30690282

SCHEMBL30690282

O=C(Cl)Cc1cccnc1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.69
CYP1A2 P05177 2/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2C9 P11712 1/20 0.61
KDM4E B2RXH2 1/20 0.54
RECQL P46063 1/20 0.51
CYP17A1 P05093 2/20 0.51
CYP19A1 P11511 2/20 0.51
TBXAS1 P24557 4/20 0.50
FDPS P14324 1/20 0.49
CYP2D6 P10635 1/20 0.48
FNTA P49354 1/20 0.48
FNTB P49356 1/20 0.48
EPHX2 P34913 1/20 0.48

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
SCHEMBL2339100 1.00 NAPRT (0.69) NAPRTCYP1A2CYP3A4CYP2C9KDM4E
Hydrochloric Acid SCHEMBL16238944 0.98 NAPRT (0.67) NAPRTCYP1A2CYP3A4CYP2C9KDM4E
SCHEMBL15976191 0.84 NAPRT (0.69) NAPRTCYP1A2CYP3A4CYP2C9KDM4E
SCHEMBL3253168 0.83 NAPRT (0.74) NAPRTCYP1A2CYP3A4CYP2C9KDM4E
SCHEMBL48609 0.82 NAPRT (1.00) NAPRTCYP1A2CYP3A4CYP2C9KDM4E
SCHEMBL15515595 0.82 NAPRT (0.71) NAPRTCYP1A2CYP3A4CYP2C9KDM4E
SCHEMBL29430342 0.82 NAPRT (1.00) NAPRTCYP1A2CYP3A4CYP2C9KDM4E
SCHEMBL1283208 0.81 TBXAS1 (0.60) NAPRTCYP1A2CYP3A4CYP2C9RECQL
SCHEMBL4851788 0.80 NAPRT (0.69) NAPRTCYP1A2CYP3A4CYP2C9KDM4E
Hydrochloric Acid SCHEMBL5332088 0.80 NAPRT (0.96) NAPRTCYP1A2CYP3A4CYP2C9KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119177519-A Water-jet non-woven fabric for unidirectional moisture-conducting paper diaper surface layer and preparation method thereof 浙江王金非织造布有限公司 2024-12-24 CN claimed
CN-119177519-A Water-jet non-woven fabric for unidirectional moisture-conducting paper diaper surface layer and preparation method thereof 浙江王金非织造布有限公司 2024-12-24 CN disclosed
WO-2023250513-A1 13-MEMBERED MACROLIDE COMPOUNDS FOR TREATING DISEASES MEDIATED BY ABNORMAL PROTEIN TRANSLATION ZIKANI THERAPEUTICS, INC. (US) 2023-12-28 WO disclosed