SCHEMBL8137693

SCHEMBL8137693

CCOC(=O)c1cccc(S(=O)(=O)Nc2ccc3c(c2)nc(Cc2ccc(C#N)cc2)n3C)c1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F2 P00734 9/20 0.56
SMN1; SMN2 Q16637 3/20 0.45
LMNA P02545 3/20 0.45
ALDH1A1 P00352 1/20 0.44
PKM P14618 1/20 0.44
POLB P06746 1/20 0.44
PAX8 Q06710 1/20 0.44
BRPF1 P55201 2/20 0.43
BRD1 O95696 1/20 0.43
DDX3X O00571 1/20 0.42

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
Hydrochloric Acid SCHEMBL8027596 0.87 F2 (0.73) F2SMN1; SMN2LMNAALDH1A1PKM
SCHEMBL6970167 0.84 SMN1; SMN2 (0.51) F2SMN1; SMN2LMNAALDH1A1PKM
SCHEMBL8027058 0.84 F2 (0.70) F2SMN1; SMN2LMNAALDH1A1PKM
SCHEMBL6978112 0.81 F2 (0.49) F2SMN1; SMN2LMNAALDH1A1PKM
SCHEMBL8032464 0.81 F2 (0.53) F2SMN1; SMN2LMNAALDH1A1PKM
SCHEMBL8032270 0.81 F2 (0.72) F2SMN1; SMN2LMNAPOLBPAX8
SCHEMBL8028365 0.80 F2 (0.73) F2SMN1; SMN2LMNAALDH1A1PKM
SCHEMBL8028279 0.80 F2 (0.59) F2SMN1; SMN2LMNAALDH1A1PKM
SCHEMBL8029744 0.79 F2 (0.60) F2SMN1; SMN2LMNAALDH1A1PKM
SCHEMBL8016259 0.79 F2 (0.58) F2SMN1; SMN2LMNAPKMPOLB

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-1060166-A1 FIVE-MEMBERED, BENZO-CONDENSED HETEROCYCLES USED AS ANTITHROMBOTIC AGENTS Boehringer Ingelheim Pharma KG (DE) 2000-12-20 EP disclosed
WO-1999040072-A1 FIVE-MEMBERED, BENZO-CONDENSED HETEROCYCLES USED AS ANTITHROMBOTIC AGENTS BOEHRINGER INGELHEIM PHARMA KG (DE) 1999-08-12 WO disclosed