SCHEMBL8329371

SCHEMBL8329371

N#Cc1c(C(=O)O)c2n(c1-c1cccnc1Cl)CCCC2O

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.35
DHODH Q02127 6/20 0.35
KCNMA1 Q12791 3/20 0.34
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM4E B2RXH2 2/20 0.31
RECQL P46063 1/20 0.31
UCHL1 P09936 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
ELANE P08246 3/20 0.31
PDE4B Q07343 1/20 0.31
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 1/20 0.30

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
SCHEMBL7952967 0.91 DPP4 (0.35) DPP4DHODHKCNMA1KDM4ERECQL
SCHEMBL7964348 0.91 KDM4E (0.35) DPP4KCNMA1KDM4ERECQLUCHL1
SCHEMBL7963885 0.89 KCNMA1 (0.36) DPP4KCNMA1LMNASMN1; SMN2KDM4E
SCHEMBL8327934 0.88 DHODH (0.35) DHODHKCNMA1KDM4ERECQLUCHL1
SCHEMBL7961452 0.87 KCNMA1 (0.38) DPP4KCNMA1KDM4ERECQLALDH1A1
SCHEMBL8330160 0.86 DHODH (0.38) DHODHLMNASMN1; SMN2ALDH1A1HCRTR1
SCHEMBL7963738 0.84 KCNMA1 (0.37) DPP4KCNMA1
SCHEMBL7967718 0.82 KCNMA1 (0.36) DPP4DHODHKCNMA1RAB9AHCRTR1
SCHEMBL8328923 0.82 DHODH (0.37) DHODHLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL8327037 0.81 UCHL1 (0.41) LMNAKDM4EUCHL1ALDH1A1GAA

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
EP-0946555-A1 PYRROLE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Aventis Pharma S.A. (FR) 1999-10-06 EP claimed
WO-1998025925-A1 PYRROLE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM RHONE-POULENC RORER S.A. (FR) 1998-06-18 WO claimed