SCHEMBL24964449

SCHEMBL24964449

Cc1cc2cc(N(C)C)ccc2o1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 1/20 0.47
▸ APP P05067 12/20 0.46
▸ PGR P06401 1/20 0.44
▸ TERT O14746 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.39
▸ TSHR P16473 2/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ EGFR P00533 2/20 0.38
▸ PDGFRB P09619 1/20 0.38
▸ KDR P35968 1/20 0.38
▸ SLC16A3 O15427 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ CASP3 P42574 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.37

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
SCHEMBL24840948 0.84 SLC16A3 (0.53) APPPGRTERTALDH1A1TSHR
SCHEMBL22289661 0.79 DYRK1A (0.41) DYRK1AAPPPGRALDH1A1ALOX15
SCHEMBL16284307 0.78 SLC16A3 (0.48) APPPGRALDH1A1ALOX15HSD17B10
SCHEMBL23172755 0.76 APP (0.43) APPPGRTERTALDH1A1TSHR
SCHEMBL9947486 0.75 APP (0.66) APPPGRALDH1A1TSHRRAB9A
SCHEMBL27448031 0.74 LOXL2 (0.53) APPPGRTERTSLC16A3MEN1
SCHEMBL14197740 0.74 CYP2A6 (0.57) APPPGR
SCHEMBL170369 0.74 ALDH1A1 (0.55) DYRK1AAPPALDH1A1
SCHEMBL15398186 0.73 PGR (0.76) PGRALDH1A1TSHRALOX15HSD17B10
SCHEMBL22311492 0.72 PAX8 (0.41) DYRK1AAPPALDH1A1HSD17B10MEN1

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-2023001061-A1 CDK7 SELECTIVE INHIBITORS AS ANTICANCER AGENTS JINGRUI BIOPHARMA CO., LTD. (CN) 2023-01-26 — — WO disclosed
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