SCHEMBL9185296

SCHEMBL9185296

COCc1ncc2c(n1)N(Cc1ccc(Br)cc1)C(=O)C(C)C2

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP1 O94782 11/20 0.36
NPSR1 Q6W5P4 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
RAB9A P51151 1/20 0.35
TDP1 Q9NUW8 1/20 0.33
ACHE P22303 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
PKM P14618 1/20 0.32
HIF1A Q16665 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL9186353 0.87 USP1 (0.36) USP1KMT2AACHE
SCHEMBL7435529 0.70 AGTR1 (0.44) NPSR1MEN1KMT2ALMNATSHR
SCHEMBL31398271 0.67 PARK7 (0.46) MEN1KMT2AACHEALDH1A1MAPT
SCHEMBL30489385 0.65 ALDH1A1 (0.53) MEN1KMT2AACHEALDH1A1MAPT
SCHEMBL28995174 0.65 ALDH1A1 (0.53) MEN1KMT2AACHEALDH1A1MAPT
SCHEMBL31414463 0.61 XIAP (0.51) MEN1KMT2ALMNARAB9A
SCHEMBL26604864 0.61 XIAP (0.51) MEN1KMT2ALMNARAB9A
SCHEMBL30489292 0.61 POLB (0.55) MEN1KMT2AALDH1A1POLB
SCHEMBL29839407 0.61 CMA1 (0.58) MEN1KMT2ALMNATSHRALDH1A1
SCHEMBL28995159 0.61 POLB (0.55) MEN1KMT2AALDH1A1POLB

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-5466692-A Substituted pyridopyrimidines and antihypertensives AMERICAN HOME PRODUCTS CORPORATION (US) 1995-11-14 US disclosed