SCHEMBL7085169

SCHEMBL7085169

Oc1ccc(-c2cnn(Cc3ccccc3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 1/20 0.46
▸ CYP19A1 P11511 2/20 0.46
▸ ESR1 P03372 2/20 0.45
▸ FYN P06241 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.43
▸ HPGD P15428 3/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ MET P08581 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ NTSR1 P30989 1/20 0.41
▸ ABCB1 P08183 1/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ NFKB2 Q00653 1/20 0.40
▸ RELA Q04206 1/20 0.40

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
SCHEMBL29009118 0.88 CYP19A1 (0.53) CYP19A1ALDH1A1HPGDKMT2AKDM4E
SCHEMBL29009119 0.85 CYP19A1 (0.47) CYP19A1ALDH1A1HPGDKMT2AKDM4E
SCHEMBL29009141 0.84 NPC1 (0.47) CYP19A1ALDH1A1HPGDKMT2AKDM4E
SCHEMBL29009139 0.83 RAB9A (0.51) CYP19A1ALDH1A1KMT2AKDM4EL3MBTL1
SCHEMBL6156159 0.81 CYP19A1 (0.46) CYP19A1ALDH1A1HPGDKMT2AHSD17B10
SCHEMBL8861975 0.80 CYP19A1 (0.42) CYP19A1ALDH1A1KMT2AL3MBTL1MEN1
SCHEMBL29009122 0.80 KMT2A (0.47) CYP19A1KMT2AMEN1SMN1; SMN2
SCHEMBL29009112 0.80 CXCR2 (0.47) CYP19A1LMNABCHEPOLBMAPT
SCHEMBL17233354 0.76 CHRM2 (0.43) ESR1FYNALDH1A1HPGDKMT2A
SCHEMBL7996514 0.73 SMN1; SMN2 (0.56) ESR1KMT2AMEN1LMNASMN1; SMN2

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-20030191023-A1 Thermosensitive recording material FUJI PHOTO FILM CO., LTD. 2003-10-09 — — US disclosed
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