SCHEMBL29907266

SCHEMBL29907266

c1ccc2c(c1)Cc1c-2ccc2c1CCCCN2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 1/20 0.42
▸ PNMT P11086 1/20 0.38
▸ CDK1 P06493 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA4 P22748 1/20 0.35
▸ CA6 P23280 1/20 0.35
▸ MAP3K9 P80192 1/20 0.35
▸ MAP3K11 Q16584 1/20 0.35
▸ GRIA1 P42261 1/20 0.35
▸ GRIA2 P42262 1/20 0.35
▸ GRIA3 P42263 1/20 0.35
▸ GRIA4 P48058 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ BCHE P06276 1/20 0.35
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ HPGD P15428 2/20 0.34
▸ KDM4E B2RXH2 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
SCHEMBL1632063 0.83 PNMT (0.42) PGRPNMTCA1CA2CA4
SCHEMBL3396448 0.76 TSHR (0.44) PGRPNMTNPC1RAB9AHPGD
SCHEMBL22263591 0.75 PNMT (0.57) PGRPNMTCA1CA2CA4
SCHEMBL23704623 0.75 PNMT (0.43) PGRPNMTNPC1RAB9AHPGD
SCHEMBL29576506 0.73 PNMT (0.44) PGRPNMTCA1CA2CA4
Fluorene SCHEMBL15052014 0.71 ALOX15 (0.46) CA1CA2BCHENPC1RAB9A
SCHEMBL4929162 0.71 GRIA1 (0.55) CA1CA2GRIA1GRIA2GRIA3
SCHEMBL30631774 0.70 PGR (0.49) PGRPNMTCDK1CDK2CA1
SCHEMBL30566335 0.69 ALDH1A1 (0.52) PGRPNMTCA1CA2CA4
SCHEMBL20402090 0.69 MAOA (0.56) PNMTMAP3K9MAP3K11BCHENPC1

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
CN-115280147-A UV excitable polyfluorene-based conjugates and their use in analyte detection methods 阿特生物探索公司 2022-11-01 — — CN disclosed
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