SCHEMBL10919746

SCHEMBL10919746

C=C(c1ccccc1)n1cnc2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DNMT3A Q9Y6K1 1/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ LMNA P02545 1/20 0.51
▸ STAT6 P42226 1/20 0.51
▸ KMT2A Q03164 3/20 0.50
▸ ASAH1 Q13510 2/20 0.48
▸ MEN1 O00255 1/20 0.47
▸ HTT P42858 2/20 0.46
▸ NPC1 O15118 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ ADRB2 P07550 2/20 0.43
▸ ADRB1 P08588 2/20 0.43
▸ ADRB3 P13945 2/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ TNF P01375 1/20 0.42
▸ CYP11B1 P15538 1/20 0.42

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
SCHEMBL10979942 0.81 SMN1; SMN2 (0.58) DNMT3ASMN1; SMN2LMNASTAT6KMT2A
SCHEMBL3477048 0.79 KMT2A (0.77) DNMT3ASMN1; SMN2LMNASTAT6KMT2A
SCHEMBL10919675 0.78 ADRB2 (0.49) DNMT3ASMN1; SMN2LMNASTAT6KMT2A
SCHEMBL28377896 0.78 SMN1; SMN2 (0.54) DNMT3ASMN1; SMN2LMNASTAT6KMT2A
SCHEMBL29585279 0.78 SMN1; SMN2 (0.54) DNMT3ASMN1; SMN2LMNASTAT6KMT2A
SCHEMBL31561667 0.76 SMN1; SMN2 (0.53) DNMT3ASMN1; SMN2LMNASTAT6KMT2A
SCHEMBL12420180 0.76 SMN1; SMN2 (0.50) DNMT3ASMN1; SMN2LMNASTAT6KMT2A
SCHEMBL29833599 0.76 SMN1; SMN2 (0.56) DNMT3ASMN1; SMN2LMNASTAT6KMT2A
SCHEMBL29833600 0.76 SMN1; SMN2 (0.56) DNMT3ASMN1; SMN2LMNASTAT6KMT2A
SCHEMBL857765 0.76 SMN1; SMN2 (0.61) DNMT3ASMN1; SMN2LMNASTAT6KMT2A

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
CN-115594624-A Preparation method of N-terminal alkenyl azaarene 长沙资材科技有限公司(CN) 2023-01-13 — — CN disclosed
US-4587361-A N-(4-(1-PHENYLETHENYL)PHENYL)-2-HYDROXY-3,5-DIHALOBENZAMIDE SMITHKLINE BECKMAN CORPORATION (US) 1986-05-06 — — US disclosed
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