SCHEMBL8178180

SCHEMBL8178180

O=C(O)c1ccc(-c2nc(NCc3ccc(F)cc3)c3cc(Cl)sc3n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
MAPT P10636 3/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
PPARA Q07869 1/20 0.46
CYP1A2 P05177 2/20 0.44
CYP2D6 P10635 2/20 0.44
HPGD P15428 2/20 0.44
TSHR P16473 2/20 0.44
CYP2C19 P33261 2/20 0.44
USP2 O75604 1/20 0.44
CYP3A4 P08684 1/20 0.44
PTGS2 P35354 2/20 0.44
PDE5A O76074 1/20 0.42
CTNNB1 P35222 8/20 0.41
TCF7L2 Q9NQB0 8/20 0.41
POLB P06746 1/20 0.41
ALOX15 P16050 1/20 0.40
HIF1A Q16665 1/20 0.40
HSD17B10 Q99714 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
SCHEMBL8171209 0.92 CYP1A2 (0.53) LMNAMAPTMEN1KMT2ACYP1A2
SCHEMBL8179531 0.89 CTNNB1 (0.47) LMNAMAPTMEN1KMT2ACYP1A2
SCHEMBL8178013 0.89 FYN (0.48) LMNAMAPTMEN1KMT2ACYP1A2
SCHEMBL8178620 0.86 LMNA (0.47) LMNAMAPTMEN1KMT2APPARA
SCHEMBL8179222 0.86 PRKCI (0.50) LMNAMAPTMEN1KMT2APPARA
SCHEMBL5123659 0.85 PDE5A (0.49) LMNAMAPTMEN1KMT2APTGS2
SCHEMBL8178327 0.84 MEN1 (0.55) LMNAMAPTMEN1KMT2ACYP1A2
SCHEMBL8185246 0.84 MEN1 (0.45) LMNAMAPTMEN1KMT2APPARA
SCHEMBL8177243 0.84 MEN1 (0.47) LMNAMEN1KMT2ACYP1A2CYP2D6
SCHEMBL7018750 0.84 PDE5A (0.52) LMNAMAPTMEN1KMT2ACYP1A2

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-6130223-A Thienopyrimidine with phosphodiesterase V inhibiting effect MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2000-10-10 US disclosed