SCHEMBL31444642

SCHEMBL31444642

CC(C)(O)CCn1ccc2ccc(N)cc21

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PRKCI P41743 1/20 0.40
▸ KMO O15229 1/20 0.38
▸ HTR2C P28335 4/20 0.38
▸ HTR2A P28223 3/20 0.38
▸ HTR7 P34969 1/20 0.37
▸ MCL1 Q07820 3/20 0.37
▸ MTNR1A P48039 3/20 0.36
▸ MTNR1B P49286 3/20 0.36
▸ HTR1D P28221 1/20 0.36
▸ CDK4 P11802 1/20 0.36
▸ CCND1 P24385 1/20 0.36
▸ HTR6 P50406 1/20 0.36
▸ LMNA P02545 1/20 0.35

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
SCHEMBL8648989 0.79 EGFR (0.48) PRKCIKMOHTR2CHTR2AHTR7
SCHEMBL2035199 0.78 CDK4 (0.63) HTR2CHTR2AMTNR1AMTNR1BCDK4
SCHEMBL23413236 0.77 KMO (0.44) PRKCIKMOHTR2CHTR2AHTR7
SCHEMBL29780573 0.77 KMO (0.44) PRKCIKMOHTR2CHTR2AHTR7
SCHEMBL27812843 0.76 CDK4 (0.44) PRKCIHTR2CHTR2AMCL1MTNR1A
SCHEMBL27659461 0.76 HTR2C (0.40) PRKCIHTR2CHTR2AHTR7HTR1D
SCHEMBL26621536 0.76 HTR7 (0.56) KMOHTR7MTNR1AMTNR1BLMNA
SCHEMBL3345985 0.75 PRKCI (0.44) PRKCIHTR2CHTR2AMTNR1AMTNR1B
SCHEMBL1122347 0.75 HTR2C (0.64) HTR2CHTR2AHTR1DHTR6
SCHEMBL15770690 0.74 CYP19A1 (0.41) HTR2CHTR2AHTR7MCL1MTNR1A

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-2025096710-A1 MODULATORS OF BCL6 AS LIGAND DIRECTED DEGRADERS BRISTOL-MYERS SQUIBB COMPANY (US) 2025-05-08 — — WO disclosed
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