SCHEMBL4056491

SCHEMBL4056491

CN1Cc2ccccc2C(=O)c2cccnc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAOA P21397 1/20 0.43
GAA P10253 1/20 0.42
KMT2A Q03164 2/20 0.40
POLB P06746 1/20 0.40
CYP11B2 P19099 1/20 0.39
BRD4 O60885 1/20 0.39
CREBBP Q92793 1/20 0.39
CES1 P23141 2/20 0.39
PTPRC P08575 2/20 0.39
CTSL P07711 1/20 0.39
CTSS P25774 1/20 0.39
PTPN13 Q12923 1/20 0.39
MIF P14174 1/20 0.38
TDP2 O95551 1/20 0.38
NSD2 O96028 1/20 0.38
ABL1 P00519 1/20 0.38
PLCG1 P19174 1/20 0.38
PAX8 Q06710 1/20 0.38

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
SCHEMBL4054259 0.83 LMNA (0.40) LMNASMN1; SMN2MAOAGAA
SCHEMBL4057268 0.83 SMN1; SMN2 (0.41) LMNASMN1; SMN2GAAKMT2APOLB
SCHEMBL4060100 0.79 MAPT (0.53) LMNASMN1; SMN2GAABRD4CES1
SCHEMBL86299 0.75 MAOA (0.50) LMNAMAOAKMT2ABRD4CREBBP
Ethylene SCHEMBL7815591 0.72 MAOA (0.47) LMNAMAOAKMT2ABRD4CREBBP
SCHEMBL29455643 0.70 KMT2A (0.63) SMN1; SMN2KMT2ACYP11B2BRD4CREBBP
SCHEMBL470341 0.70 KMT2A (0.63) SMN1; SMN2KMT2ACYP11B2BRD4CREBBP
SCHEMBL11732830 0.70 LMNA (0.44) LMNASMN1; SMN2GAACYP11B2BRD4
SCHEMBL2477071 0.69 CASP3 (0.52) GAAKMT2APOLBBRD4CES1
SCHEMBL19643828 0.69 LMNA (0.41) LMNAGAAKMT2ACES1TDP2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7557212-B2 Tricyclic derivatives as LTD4 antagonists LABORATORIOS ALMIRALL, S.A. (ES) 2009-07-07 US disclosed
US-7557212-B2 Tricyclic derivatives as LTD4 antagonists LABORATORIOS ALMIRALL, S.A. (ES) 2009-07-07 US disclosed
US-7557212-B2 Tricyclic derivatives as LTD4 antagonists LABORATORIOS ALMIRALL, S.A. (ES) 2009-07-07 US disclosed
EP-1560834-B1 NEW TRICYCLIC DERIVATIVES AS LTD4 ANTAGONISTS ALMIRALL LAB (ES) 2008-06-25 EP disclosed