SCHEMBL20184301

SCHEMBL20184301

O=CN1CCc2c(-c3ccccc3)n[nH]c2C1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.55
▸ MAPK10 P53779 1/20 0.55
▸ HTR7 P34969 1/20 0.52
▸ P2RX7 Q99572 5/20 0.52
▸ USP7 Q93009 1/20 0.51
▸ BRD4 O60885 1/20 0.49
▸ CREBBP Q92793 1/20 0.49
▸ MAPK1 P28482 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HPGD P15428 1/20 0.39

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
SCHEMBL18400237 0.89 BRD4 (0.58) LMNAMAPK10HTR7P2RX7USP7
SCHEMBL22728032 0.74 PDE4D (0.34) —
SCHEMBL646266 0.72 LMNA (1.00) LMNAMAPK10HTR7USP7MAPK1
SCHEMBL11622018 0.72 LMNA (0.93) LMNAMAPK10HTR7USP7BRD4
SCHEMBL11982661 0.71 P2RX7 (0.52) LMNAP2RX7MAPK1MAPTHPGD
SCHEMBL16036558 0.71 P2RX7 (0.78) P2RX7BRD4CREBBP
SCHEMBL17244880 0.71 P2RX7 (0.66) LMNAMAPK10P2RX7BRD4CREBBP
SCHEMBL19941936 0.71 USP7 (0.61) LMNAMAPK10HTR7P2RX7USP7
SCHEMBL17347021 0.71 USP7 (0.61) LMNAMAPK10HTR7P2RX7USP7
SCHEMBL10095277 0.71 CYP2C19 (0.71) LMNAMAPK10HTR7USP7BRD4

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
EP-2970267-B3 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-30 — — EP claimed
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