SCHEMBL14754458

SCHEMBL14754458

COc1scnc1-c1ccc(Cl)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.38
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CASP1 P29466 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALOX5 P09917 3/20 0.35
DHODH Q02127 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
PDE10A Q9Y233 1/20 0.35
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
F2RL3 Q96RI0 1/20 0.34

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
SCHEMBL1082932 0.79 FFAR4 (0.41) FFAR4MEN1KMT2ADHODHPTGDR2
SCHEMBL10280239 0.76 FFAR4 (0.40) FFAR4PTGDR2KDM4ELMNAGAA
SCHEMBL19036518 0.72 KDM4E (0.37) FFAR4KMT2AALDH1A1CYP1A2HSD17B10
SCHEMBL31609715 0.72 KDM4E (0.37) FFAR4MEN1KMT2AALDH1A1CYP1A2
SCHEMBL19627014 0.71 ALDH1A1 (0.51) MEN1KMT2AALDH1A1ALOX5DHODH
SCHEMBL4539286 0.71 FFAR4 (0.45) FFAR4MEN1KMT2AALDH1A1CYP1A2
SCHEMBL9256402 0.71 KMT2A (0.45) KMT2AALDH1A1KDM4ELMNAL3MBTL1
SCHEMBL17626152 0.70 PTGDR2 (0.37) MEN1KMT2ACYP1A2ALOX5DHODH
SCHEMBL4526389 0.68 GYS1 (0.37) FFAR4ALDH1A1HSD17B10ALOX5DHODH
SCHEMBL3290454 0.68 FFAR4 (0.43) FFAR4ALDH1A1CYP1A2PTGDR2KDM4E

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-20130059869-A1 METHODS AND COMPOSITIONS FOR TREATING DISORDERS HYDRA BIOSCIENCES, INC. 2013-03-07 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-20130059869-A1 METHODS AND COMPOSITIONS FOR TREATING DISORDERS TRPA1, TRPV1, TRPV3 FFAR4 1016/4885MEN1 3610/4885KMT2A 4200/4885

“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.