SCHEMBL30677085

SCHEMBL30677085

CC(C)c1cc(C(F)(F)F)nn1-c1ccc(CNc2nc(Cl)ncc2[N+](=O)[O-])cc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PRKCQ Q04759 5/20 0.40
▸ PIN1 Q13526 2/20 0.39
▸ MAPT P10636 3/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ SERPINE1 P05121 2/20 0.37
▸ MEN1 O00255 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ PTGS2 P35354 3/20 0.35
▸ PTGS1 P23219 2/20 0.35
▸ PDE2A O00408 1/20 0.35
▸ USP1 O94782 2/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL22121968 0.89 STIM1 (0.42) PRKCQPIN1MAPTSERPINE1PTGS2
SCHEMBL30677054 0.87 PRKCQ (0.38) PRKCQPIN1MAPTCYP1A2CYP2C9
SCHEMBL29878746 0.87 USP1 (0.42) PRKCQPIN1CYP1A2CYP2C9CYP2C19
SCHEMBL30677084 0.87 PRKCQ (0.40) PRKCQPIN1SERPINE1PTGS2PTGS1
SCHEMBL27031390 0.87 USP1 (0.42) PRKCQPIN1CYP1A2CYP2C9CYP2C19
SCHEMBL30443138 0.87 PDE2A (0.37) PTGS2PTGS1PDE2AUSP1
SCHEMBL27031673 0.86 PRKCQ (0.40) PRKCQPIN1MAPTSERPINE1NPC1
SCHEMBL29878665 0.86 PRKCQ (0.40) PRKCQPIN1MAPTSERPINE1NPC1
SCHEMBL30677021 0.85 USP1 (0.40) PTGS2PTGS1PDE2AUSP1
SCHEMBL30677221 0.84 SMN1; SMN2 (0.37) MAPTCYP1A2CYP2C9CYP2C19ALDH1A1

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
EP-4543890-A1 USP1 INHIBITORS AND USES THEREOF Forma Therapeutics, Inc. (US) 2025-04-30 — — EP disclosed
CN-119731178-A USP1 inhibitors and uses thereof 福马治疗有限公司 2025-03-28 — — CN disclosed
WO-2023250084-A1 USP1 INHIBITORS AND USES THEREOF FORMA THERAPEUTICS, INC. (US) 2023-12-28 — — WO disclosed
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