SCHEMBL31634694

SCHEMBL31634694

Cc1nc(N[C@@H]2CNC[C@@H]2C)ccc1-c1ncccn1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 2/20 0.35
▸ HCRTR1 O43613 13/20 0.34
▸ HCRTR2 O43614 10/20 0.34
▸ HRH3 Q9Y5N1 1/20 0.34
▸ CYP1A2 P05177 3/20 0.33
▸ CYP2C19 P33261 2/20 0.33
▸ TDP1 Q9NUW8 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ CLK4 Q9HAZ1 1/20 0.32

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
SCHEMBL30833322 0.78 CYP1A2 (0.47) MC4RHRH3CYP1A2CYP2C19TDP1
SCHEMBL31687286 0.78 CYP1A2 (0.47) MC4RHRH3CYP1A2CYP2C19TDP1
Hydrochloric Acid SCHEMBL30457682 0.77 CYP1A2 (0.46) MC4RHRH3CYP1A2CYP2C19TDP1
SCHEMBL31634704 0.75 MC4R (0.34) MC4RHCRTR1HCRTR2CYP1A2CYP2C19
SCHEMBL31687277 0.75 MC4R (0.34) MC4RHCRTR1HCRTR2CYP1A2CYP2C19
SCHEMBL30948988 0.71 USP30 (0.43) MC4RHCRTR1HCRTR2
SCHEMBL31687296 0.66 CYP1A2 (0.46) HRH3CYP1A2CYP2C19TDP1CYP3A4
SCHEMBL25278377 0.65 MC4R (0.59) MC4R
SCHEMBL31687285 0.65 FLT3 (0.45) HRH3CYP1A2CYP2C19
SCHEMBL10262761 0.64 BRAF (0.45) HCRTR1HCRTR2CYP1A2CYP2C19TDP1

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-4620955-A1 MC4R ANTAGONIST COMPOUND, PHARMACEUTICAL COMPOSITION AND PHARMACEUTICAL USE THEREOF Changchun Genescience Pharmaceutical Co., Ltd. (CN) 2025-09-24 — — EP disclosed
CN-120202199-A MC4R antagonist compound, pharmaceutical composition and application thereof in medicine 长春金赛药业有限责任公司 2025-06-24 — — CN disclosed
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