SCHEMBL5477339

SCHEMBL5477339

CC(=O)/C=C(/C)Nc1cccc(C)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.66
KMT2A Q03164 4/20 0.56
MEN1 O00255 3/20 0.56
RXFP1 Q9HBX9 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.55
RAB9A P51151 3/20 0.55
NPC1 O15118 2/20 0.55
TP53 P04637 2/20 0.55
MAPT P10636 2/20 0.55
NPSR1 Q6W5P4 2/20 0.55
HTT P42858 1/20 0.55
KCNK3 O14649 1/20 0.51
KCNH2 Q12809 1/20 0.51
KCNK9 Q9NPC2 1/20 0.51
PKM P14618 1/20 0.51
HPGD P15428 1/20 0.51
MMP1 P03956 2/20 0.51
MMP2 P08253 2/20 0.51
MMP9 P14780 2/20 0.51
EGFR P00533 1/20 0.51

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
SCHEMBL14520811 1.00 HSD17B10 (0.66) HSD17B10KMT2AMEN1RXFP1SMN1; SMN2
SCHEMBL5477342 1.00 HSD17B10 (0.66) HSD17B10KMT2AMEN1RXFP1SMN1; SMN2
SCHEMBL4687025 0.88 HSD17B10 (0.64) HSD17B10KMT2AMEN1RXFP1SMN1; SMN2
SCHEMBL4687017 0.88 HSD17B10 (0.64) HSD17B10KMT2AMEN1RXFP1SMN1; SMN2
SCHEMBL4687023 0.88 HSD17B10 (0.64) HSD17B10KMT2AMEN1RXFP1SMN1; SMN2
SCHEMBL2886489 0.82 HSD17B10 (0.55) HSD17B10KMT2AMEN1RXFP1SMN1; SMN2
SCHEMBL2886492 0.82 HSD17B10 (0.55) HSD17B10KMT2AMEN1RXFP1SMN1; SMN2
SCHEMBL14315225 0.80 HSD17B10 (0.53) HSD17B10KMT2AMEN1RXFP1SMN1; SMN2
SCHEMBL317471 0.80 MAPT (0.63) HSD17B10KMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL317470 0.80 MAPT (0.63) HSD17B10KMT2AMEN1SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7199136-B2 1,4-dihydro-1,4-diphenylpyridine derivatives BAYER HEALTHCARE AG (DE) 2007-04-03 US disclosed
EP-1458682-B1 1,4-DIHYDRO-1,4-DIPHENYLPYRIDINE DERIVATIVES BAYER HEALTHCARE AG (DE) 2006-08-30 EP disclosed
US-20050165014-A1 Antiinflammatory agents, neutrophil elastase inhibitors; chronic obstructive pulmonary diseases BAYER HEALTHCARE AG 2005-07-28 US disclosed
EP-1458682-A1 1,4-DIHYDRO-1,4-DIPHENYLPYRIDINE DERIVATIVES Bayer HealthCare AG (DE) 2004-09-22 EP disclosed
WO-2003053930-A1 1,4-DIHYDRO-1,4-DIPHENYLPYRIDINE DERIVATIVES BAYER HEALTHCARE AG (DE) 2003-07-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050165014-A1 Antiinflammatory agents, neutrophil elastase inhibitors; chronic obstructive pulmonary diseases SERPINB1, ELANE, MPO HSD17B10 2446/4885KMT2A 4335/4885MEN1 4872/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.