SCHEMBL11538807

SCHEMBL11538807

O=C(Nc1ccc(Br)cc1)Nc1ccccc1-n1ccnc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.67
▸ MEN1 O00255 4/20 0.67
▸ NPC1 O15118 3/20 0.53
▸ RAB9A P51151 3/20 0.53
▸ MAPT P10636 2/20 0.53
▸ LMNA P02545 2/20 0.53
▸ HTT P42858 2/20 0.53
▸ CASP3 P42574 1/20 0.53
▸ SENP8 Q96LD8 1/20 0.53
▸ SENP7 Q9BQF6 1/20 0.53
▸ SENP6 Q9GZR1 1/20 0.53
▸ MAOA P21397 1/20 0.51
▸ MAOB P27338 1/20 0.51
▸ CYP3A4 P08684 1/20 0.49
▸ IDO1 P14902 1/20 0.49
▸ IDH2 P48735 1/20 0.46
▸ STING1 Q86WV6 1/20 0.45
▸ POLB P06746 2/20 0.45
▸ ABCG2 Q9UNQ0 1/20 0.43
▸ BTK Q06187 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
SCHEMBL11541657 0.91 MEN1 (0.76) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL11537220 0.88 MEN1 (0.76) KMT2AMEN1CYP3A4IDO1IDH2
SCHEMBL11537127 0.87 MEN1 (0.67) KMT2AMEN1CYP3A4IDO1IDH2
SCHEMBL11535044 0.87 MEN1 (0.78) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL11539010 0.87 KMT2A (0.67) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL11541067 0.87 MEN1 (0.63) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL11536064 0.85 KMT2A (0.65) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL11464531 0.85 CYP3A4 (0.55) KMT2AMEN1LMNAMAOBCYP3A4
SCHEMBL11537243 0.84 KMT2A (0.67) KMT2AMEN1NPC1RAB9ACYP3A4
SCHEMBL11538004 0.84 MEN1 (0.64) KMT2AMEN1MAPTLMNACYP3A4

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
US-4160097-A INTERMEDIATES FOR FUNGICIDAL AND ANTIINFLAMMATORY 4-SUBSTITUTED IMIDAZO(1,2-A)QUINOXALINES WESTWIND PHARMACEUTICALS, INC. (US) 1979-07-03 — — US claimed
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