SCHEMBL27740756

SCHEMBL27740756

N#Cc1cnc2ccc(OCCCl)cc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 2/20 0.50
▸ SLC6A2 P23975 4/20 0.41
▸ SLC6A4 P31645 4/20 0.41
▸ SLC6A3 Q01959 2/20 0.41
▸ HTR3A P46098 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ PDE3B Q13370 2/20 0.38
▸ PDE3A Q14432 2/20 0.38
▸ P2RY12 Q9H244 2/20 0.38
▸ NQO1 P15559 1/20 0.37
▸ PDGFRB P09619 1/20 0.37
▸ PDGFRA P16234 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ MAPT P10636 1/20 0.36

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
SCHEMBL28307100 0.88 HPGDS (0.52) HPGDSSLC6A2SLC6A4SLC6A3HTR3A
SCHEMBL28120216 0.82 HPGDS (0.56) HPGDSPDE3BPDE3ANQO1PDGFRB
SCHEMBL6990269 0.79 HPGDS (0.77) HPGDSNQO1PDGFRBPDGFRAALDH1A1
Hydrochloric Acid SCHEMBL29902485 0.78 HPGDS (0.75) HPGDSNQO1PDGFRBPDGFRAALDH1A1
SCHEMBL17442542 0.76 HPGDS (0.44) HPGDSALDH1A1HTTCYP3A4MAP4K4
SCHEMBL17327692 0.74 HPGDS (0.69) HPGDSNQO1PDGFRBPDGFRAALDH1A1
SCHEMBL7447851 0.74 ALDH1A1 (0.53) ALDH1A1MAPT
SCHEMBL27555688 0.73 HPGDS (0.72) HPGDSNQO1PDGFRBPDGFRAALDH1A1
SCHEMBL15753147 0.71 HPGDS (0.47) HPGDSNQO1ALDH1A1HPGDMEN1
SCHEMBL29624688 0.71 HPGDS (0.73) HPGDSNQO1PDGFRBPDGFRAALDH1A1

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
CN-102743382-A Methods and compositions for stimulating neurogenesis and inhibiting neuronal degeneration NEURONASCENT INC 2012-10-24 — — CN disclosed
CN-101304743-B Methods and compositions for stimulating neurogenesis and inhibiting neuronal degeneration NEURONASCENT INC 2012-09-05 — — CN disclosed
CN-101304743-A Methods and compositions for stimulating neurogenesis and inhibiting neuronal degeneration NEURONASCENT INC (US) 2008-11-12 — — CN disclosed
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