SCHEMBL10057960

SCHEMBL10057960

CCCCCCc1c2c(c(CCCCCC)c3c1sc1ccccc13)C(=O)c1c(c(CCCCCC)c3c(sc4ccccc43)c1CCCCCC)C2=O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
FAAH O00519 1/20 0.40
MGLL Q99685 1/20 0.40
CTSV O60911 1/20 0.39
CTSL P07711 1/20 0.39
CNR2 P34972 2/20 0.39
CNR1 P21554 1/20 0.39
GAA P10253 1/20 0.39
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PTPN1 P18031 1/20 0.37
GPR35 Q9HC97 1/20 0.37
TNKS O95271 1/20 0.37
TNKS2 Q9H2K2 1/20 0.37

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
SCHEMBL1518894 0.84 CNR2 (0.41) ALDH1A1KDM4EHPGDHSD17B10FAAH
SCHEMBL10058033 0.82 L3MBTL1 (0.39) ALDH1A1KDM4EHPGDHSD17B10FAAH
SCHEMBL10058007 0.82 L3MBTL1 (0.39) ALDH1A1KDM4EHPGDHSD17B10FAAH
SCHEMBL10057948 0.80 KDM4E (0.48) ALDH1A1KDM4EHPGDHSD17B10CTSV
SCHEMBL10057950 0.78 KDM4E (0.51) ALDH1A1KDM4EHPGDHSD17B10CTSV
SCHEMBL12211730 0.78 CNR2 (0.39) ALDH1A1KDM4EHPGDHSD17B10FAAH
SCHEMBL10058022 0.77 GPR35 (0.36) ALDH1A1KDM4EHPGDHSD17B10FAAH
SCHEMBL27804756 0.74 LIPG (0.40) ALDH1A1KDM4EHPGDHSD17B10FAAH
SCHEMBL28837376 0.73 CYP19A1 (0.49) ALDH1A1FAAHMGLLCNR2CNR1
SCHEMBL29716231 0.73 CYP19A1 (0.49) ALDH1A1FAAHMGLLCNR2CNR1

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-20120012822-A1 AROMATIC COMPOUND AND METHOD FOR PRODUCING SAME KEIO UNIVERSITY (JP) 2012-01-19 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-20120012822-A1 AROMATIC COMPOUND AND METHOD FOR PRODUCING SAME CCKBR, CCKAR, NPY2R ALDH1A1 1585/4885KDM4E 991/4885HPGD 2694/4885

“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.