SCHEMBL2854702

SCHEMBL2854702

CCN(Cc1ccncc1)C(=O)Oc1cnn(C)c1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.42
PSEN1 P49768 1/20 0.41
PSEN2 P49810 1/20 0.41
APH1B Q8WW43 1/20 0.41
NCSTN Q92542 1/20 0.41
APH1A Q96BI3 1/20 0.41
PSENEN Q9NZ42 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
LMNA P02545 4/20 0.40
TSHR P16473 3/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
FLT1 P17948 1/20 0.40
KDR P35968 1/20 0.40
MEN1 O00255 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
MAPT P10636 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
SCHEMBL2852033 0.81 LMNA (0.52) USP2NPC1RAB9ALMNATSHR
SCHEMBL2861285 0.77 MAPT (0.46) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL2850381 0.75 KDM4E (0.43) NPC1RAB9ACYP2C9FLT1KDR
SCHEMBL968701 0.69 USP2 (0.51) USP2LMNATSHRCYP2C9CYP2C19
SCHEMBL2755872 0.69 USP2 (0.60) USP2LMNATSHRCYP2C9CYP2C19
SCHEMBL2856483 0.68 ALDH1A1 (0.45) LMNACYP2C9CYP2C19MAPTCYP1A2
SCHEMBL2092776 0.68 USP2 (0.59) USP2LMNATSHRCYP2C9CYP2C19
SCHEMBL27919020 0.68 KDM4E (0.36) USP2NPC1RAB9ATSHRCYP2C19
SCHEMBL4970754 0.68 KDM4E (0.35) LMNAMEN1KMT2ACYP1A2KDM4E
SCHEMBL9232485 0.67 KMT2A (0.44) NPC1RAB9ALMNAMAPTKMT2A

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
EP-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP claimed