SCHEMBL10641968

SCHEMBL10641968

O=C(Cn1c(-c2ccc(Br)cc2)nc2cccnc21)Nc1cccnc1

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 2/20 0.48
▸ FPR2 P25090 1/20 0.47
▸ POLB P06746 1/20 0.47

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
Hydrochloric Acid SCHEMBL10387156 0.99 PKM (0.47) PKMFPR2POLB
Water SCHEMBL10386651 0.99 PKM (0.47) PKMFPR2POLB
SCHEMBL10387163 0.91 — —
SCHEMBL10387167 0.90 — —
Water SCHEMBL10387646 0.89 — —
Hydrochloric Acid SCHEMBL10386680 0.88 — —
SCHEMBL10387078 0.84 — —
SCHEMBL10386623 0.83 LMNA (0.58) POLB
SCHEMBL10642033 0.83 TSHR (0.55) POLB
SCHEMBL9693391 0.83 — —

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-4772600-A MUSCLE RELAXANTS, ANTICONVULSANTS, ANXIOLYTIC A. H. ROBINS COMPANY, INC. (US) 1988-09-20 — — US claimed
EP-0255217-A1 Fused imidazoheterocyclic compounds A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) 1988-02-03 — — EP claimed
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