SCHEMBL11873579

SCHEMBL11873579

O=Cc1cc(-c2c[nH]c3ccccc23)cc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IMPDH2 P12268 3/20 0.54
▸ CYP2A6 P11509 1/20 0.54
▸ PDGFRB P09619 2/20 0.52
▸ PDGFRA P16234 2/20 0.52
▸ TDO2 P48775 8/20 0.48
▸ ALOX5 P09917 1/20 0.48
▸ NR4A2 P43354 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ MAOB P27338 1/20 0.45
▸ PRKD3 O94806 1/20 0.43
▸ CCNB2 O95067 1/20 0.43
▸ CCNE2 O96020 1/20 0.43
▸ ABL1 P00519 1/20 0.43
▸ PRKCG P05129 1/20 0.43
▸ PRKCB P05771 1/20 0.43
▸ CDK1 P06493 1/20 0.43
▸ PIM1 P11309 1/20 0.43
▸ CDK4 P11802 1/20 0.43
▸ CCNB1 P14635 1/20 0.43

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
SCHEMBL3132450 0.80 PDGFRB (0.56) IMPDH2CYP2A6PDGFRBPDGFRATDO2
SCHEMBL11871562 0.78 CSNK2A2 (0.41) NR4A2PIM1MAPTNPSR1MEN1
SCHEMBL8730331 0.74 IMPDH2 (0.65) IMPDH2CYP2A6PDGFRBPDGFRATDO2
SCHEMBL29713619 0.74 TDO2 (0.70) IMPDH2PDGFRBPDGFRATDO2ALOX5
SCHEMBL28928045 0.73 NR4A2 (0.62) IMPDH2CYP2A6PDGFRBPDGFRATDO2
SCHEMBL10227492 0.73 AXL (0.58) IMPDH2CYP2A6PDGFRBPDGFRATDO2
SCHEMBL15333384 0.72 MAOB (0.59) IMPDH2PDGFRBPDGFRATDO2ALOX5
SCHEMBL5259184 0.72 NR4A2 (0.60) IMPDH2CYP2A6TDO2ALOX5NR4A2
3-Formylindole SCHEMBL56373 0.71 CYP2A6 (1.00) IMPDH2CYP2A6PDGFRBPDGFRAPRKD3
3-Formylindole SCHEMBL38654556 0.71 CYP2A6 (1.00) IMPDH2CYP2A6PDGFRBPDGFRAPRKD3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3983137-A Process for preparing 3-(indol-3-yl)-dehydronaphthalide hydrochlorides POLAROID CORPORATION (US) 1976-09-28 — — US claimed
US-3983137-A Process for preparing 3-(indol-3-yl)-dehydronaphthalide hydrochlorides POLAROID CORPORATION (US) 1976-09-28 — — US disclosed
US-3983137-A Process for preparing 3-(indol-3-yl)-dehydronaphthalide hydrochlorides POLAROID CORPORATION (US) 1976-09-28 — — US disclosed
US-3933854-A CHEMICAL INTERMEDIATES FOR INDICATOR DYES POLAROID CORPORATION (US) 1976-01-20 — — US disclosed
US-3933854-A CHEMICAL INTERMEDIATES FOR INDICATOR DYES POLAROID CORPORATION (US) 1976-01-20 — — US disclosed
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