SCHEMBL28451087

SCHEMBL28451087

CCOCc1nc(-c2ccc(C)cc2)c[nH]1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 6/20 0.36
▸ NPC1 O15118 3/20 0.36
▸ RAB9A P51151 3/20 0.36
▸ LMNA P02545 2/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ NFKB2 Q00653 1/20 0.36
▸ RELA Q04206 1/20 0.36
▸ KDM4E B2RXH2 5/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ HPGD P15428 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ RAD51 Q06609 1/20 0.35
▸ TARBP2 Q15633 1/20 0.35
▸ METAP2 P50579 1/20 0.34
▸ METAP1 P53582 1/20 0.34
▸ ENPP3 O14638 2/20 0.34
▸ ENPP1 P22413 2/20 0.34
▸ TRPM8 Q7Z2W7 1/20 0.34
▸ MEN1 O00255 4/20 0.33
▸ KMT2A Q03164 4/20 0.33

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
SCHEMBL27909694 0.82 RAD51 (0.42) SMN1; SMN2NPC1RAB9ALMNANFKB1
SCHEMBL28173006 0.79 TP53 (0.42) SMN1; SMN2NPC1RAB9ALMNANFKB1
SCHEMBL11352100 0.77 HTR7 (0.35) SMN1; SMN2KDM4EALDH1A1MAPTTP53
SCHEMBL27596036 0.77 KMT2A (0.39) SMN1; SMN2NPC1RAB9ALMNANFKB1
SCHEMBL11047835 0.77 METAP2 (0.38) SMN1; SMN2NPC1RAB9ALMNANFKB1
SCHEMBL4270861 0.71 P2RX7 (0.32) —
SCHEMBL3241311 0.71 NPC1 (0.45) SMN1; SMN2NPC1RAB9ANFKB1NFKB2
SCHEMBL8250696 0.70 METAP2 (0.44) SMN1; SMN2NPC1RAB9ALMNAKDM4E
SCHEMBL3234188 0.70 NPC1 (0.48) SMN1; SMN2NPC1RAB9AKDM4EALDH1A1
SCHEMBL29668083 0.69 — —

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
CN-108912052-B Preparation method of cyazofamid 江苏扬农化工集团有限公司 2020-08-14 — — CN disclosed
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