SCHEMBL20176655

SCHEMBL20176655

CCCc1cc(-c2cc(CCC)c(O)c(CCC)c2)cc(CCC)c1C

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 5/20 0.40
HMGCR P04035 1/20 0.38
GABRA1 P14867 6/20 0.38
GABRB2 P47870 6/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
DHFR P00374 1/20 0.36
MAOA P21397 1/20 0.36
PRKCI P41743 1/20 0.35
TYR P14679 1/20 0.35
PTPN1 P18031 1/20 0.35
PTPN11 Q06124 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
GABRA2 P47869 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
SCHEMBL8975468 0.91 ALOX5 (0.44) ALOX5HMGCRGABRA1GABRB2CA1
SCHEMBL22958480 0.84 PRKCE (0.40) ALOX5HMGCRGABRA1GABRB2CA1
SCHEMBL11612512 0.83 CA1 (0.54) ALOX5HMGCRGABRA1GABRB2CA1
SCHEMBL20176653 0.80 CA1 (0.52) ALOX5HMGCRGABRA1GABRB2CA1
SCHEMBL18924218 0.79 PTPN1 (0.52) ALOX5HMGCRTYRPTPN1PTPN11
SCHEMBL11374001 0.79 HMGCR (0.42) ALOX5HMGCRMAOAPRKCITYR
SCHEMBL1021760 0.79 AMY1A (0.47) ALOX5HMGCRGABRA1GABRB2CA2
SCHEMBL1022126 0.79 PTPN1 (0.47) ALOX5GABRA1GABRB2PTPN1
SCHEMBL5140860 0.77 TYR (0.50) ALOX5MAOATYR
SCHEMBL740548 0.77 AMY1A (0.45) ALOX5HMGCRGABRA1GABRB2CA2

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-20180141895-A1 DIPHENYL DERIVATIVE AND USES THEREOF XI'AN LIBANG PHARMACEUTICAL CO., LTD (CN) 2018-05-24 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-20180141895-A1 DIPHENYL DERIVATIVE AND USES THEREOF PPARD, DPP3, DPP7 ALOX5 654/4885HMGCR 1193/4885GABRA1 547/4885

“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.