SCHEMBL7666287

SCHEMBL7666287

CCCCn1cnc2c(OCC)nc(Nc3ccc(OCC)nc3)nc21

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PDGFRA P16234 8/20 0.41
▸ CCNE1 P24864 8/20 0.41
▸ CDK2 P24941 8/20 0.41
▸ CTSL P07711 5/20 0.37
▸ ADORA2A P29274 2/20 0.36
▸ NR3C1 P04150 2/20 0.36
▸ CYP1A2 P05177 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ TMIGD3 P0DMS9 1/20 0.35
▸ ADORA1 P30542 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ PDE1A P54750 1/20 0.35
▸ PDE1B Q01064 1/20 0.35
▸ PDE1C Q14123 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
SCHEMBL7674135 0.94 PDGFRA (0.43) PDGFRACCNE1CDK2CTSLADORA2A
SCHEMBL7661594 0.94 CDK2 (0.43) PDGFRACCNE1CDK2CTSL
SCHEMBL7365457 0.92 PDGFRA (0.39) PDGFRACCNE1CDK2CTSLNR3C1
SCHEMBL7661658 0.92 PDGFRA (0.38) PDGFRACCNE1CDK2CTSLADORA2A
SCHEMBL7670257 0.92 PDGFRA (0.38) PDGFRACCNE1CDK2CTSLNR3C1
SCHEMBL7356565 0.92 PDGFRA (0.38) PDGFRACCNE1CDK2CTSLADORA2A
SCHEMBL7670268 0.92 CDK2 (0.38) PDGFRACCNE1CDK2CTSLADORA2A
SCHEMBL7668529 0.92 PDGFRA (0.38) PDGFRACCNE1CDK2CTSLADORA2A
SCHEMBL7358385 0.92 CDK2 (0.39) PDGFRACCNE1CDK2CTSLADORA2A
SCHEMBL7668358 0.91 CCNE1 (0.39) PDGFRACCNE1CDK2CTSLNR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6414147-B1 DIAGNOSIS AND TREATMENT OF ANXIETY, DEPRESSION, SLEEP AND SEIZURE DISORDERS, DOWN'S SYNDROME, OVERDOSE WITH BENZODIAZEPINE DRUGS, AND FOR ENHANCEMENT OF MEMORY NEUROGEN CORPORATION 2002-07-02 — — US claimed
US-6414147-B1 DIAGNOSIS AND TREATMENT OF ANXIETY, DEPRESSION, SLEEP AND SEIZURE DISORDERS, DOWN'S SYNDROME, OVERDOSE WITH BENZODIAZEPINE DRUGS, AND FOR ENHANCEMENT OF MEMORY NEUROGEN CORPORATION 2002-07-02 — — US disclosed
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