SCHEMBL11539010

SCHEMBL11539010

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

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.67
▸ MEN1 O00255 3/20 0.67
▸ RAB9A P51151 3/20 0.56
▸ HTT P42858 3/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ NPC1 O15118 1/20 0.56
▸ POLB P06746 1/20 0.56
▸ TAAR1 Q96RJ0 1/20 0.52
▸ CD38 P28907 1/20 0.52
▸ CYP3A4 P08684 2/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ IDO1 P14902 1/20 0.49
▸ IDH2 P48735 1/20 0.48
▸ MAPT P10636 2/20 0.45
▸ STING1 Q86WV6 1/20 0.45
▸ ATR Q13535 1/20 0.44
▸ BLM P54132 1/20 0.44

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) KMT2AMEN1RAB9AHTTSMN1; SMN2
SCHEMBL11538930 0.88 MEN1 (0.76) KMT2AMEN1RAB9ASMN1; SMN2NPC1
SCHEMBL11538807 0.87 KMT2A (0.67) KMT2AMEN1RAB9AHTTNPC1
SCHEMBL11537127 0.87 MEN1 (0.67) KMT2AMEN1SMN1; SMN2POLBTAAR1
SCHEMBL11535044 0.87 MEN1 (0.78) KMT2AMEN1RAB9AHTTSMN1; SMN2
SCHEMBL11538736 0.87 KMT2A (0.63) KMT2AMEN1RAB9AHTTSMN1; SMN2
SCHEMBL11540163 0.86 MEN1 (0.60) KMT2AMEN1RAB9AHTTSMN1; SMN2
SCHEMBL11536064 0.85 KMT2A (0.65) KMT2AMEN1RAB9AHTTSMN1; SMN2
SCHEMBL11471648 0.85 KMT2A (0.57) KMT2AMEN1RAB9AHTTSMN1; SMN2
SCHEMBL11537243 0.84 KMT2A (0.67) KMT2AMEN1RAB9ASMN1; SMN2NPC1

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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