SCHEMBL13655811

SCHEMBL13655811

O=Cc1c(Br)sc(Br)c1Cc1cccc(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 3/20 0.45
LMNA P02545 3/20 0.41
MEN1 O00255 2/20 0.41
ALDH1A1 P00352 2/20 0.41
KMT2A Q03164 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CHRM2 P08172 2/20 0.38
PNMT P11086 1/20 0.38
DAO P14920 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
PTGER2 P43116 1/20 0.37
TAAR1 Q96RJ0 2/20 0.36
POLB P06746 1/20 0.36
CCR2 P41597 4/20 0.36
CCR5 P51681 1/20 0.36
HDAC1 Q13547 1/20 0.35

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
SCHEMBL13655810 0.79 PTGER4 (0.46) PTGER4LMNAMEN1ALDH1A1KMT2A
SCHEMBL13655991 0.77 PTGER4 (0.48) PTGER4LMNAMEN1ALDH1A1KMT2A
SCHEMBL13655808 0.76 PTGER4 (0.46) PTGER4LMNAMEN1ALDH1A1KMT2A
SCHEMBL17398724 0.75 DAO (0.41) PTGER4LMNAMEN1ALDH1A1KMT2A
SCHEMBL4096607 0.69 PNMT (0.44) PTGER4PNMTDAOTAAR1
SCHEMBL30579047 0.69 LMNA (0.44) LMNAMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL1680353 0.69 LMNA (0.44) LMNAMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL20546807 0.68 PNMT (0.47) LMNAMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL30644993 0.68 PNMT (0.47) LMNAMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL8992816 0.68 HSD17B10 (0.48) LMNAMEN1ALDH1A1KMT2ASMN1; SMN2

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-20090247596-A1 THIOPHENECARBOXAMIDE DERIVATIVES AS EP4 RECEPTOR LIGANDS MERCK CANADA INC. (CA) 2009-10-01 US 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-20090247596-A1 THIOPHENECARBOXAMIDE DERIVATIVES AS EP4 RECEPTOR LIGANDS PTGER4, PTGER1, PTGER2 PTGER4 1/4885LMNA 4867/4885MEN1 4754/4885

“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.