SCHEMBL6841578

SCHEMBL6841578

Cc1ccc(Cl)c(O)c1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
DPP4 P27487 1/20 0.41
TRPA1 O75762 1/20 0.40
CYP3A4 P08684 4/20 0.37
LMNA P02545 2/20 0.37
HSD17B10 Q99714 2/20 0.36
MAPK1 P28482 1/20 0.36
CHRM1 P11229 1/20 0.36
ALOX15 P16050 1/20 0.36
MAOA P21397 1/20 0.36
TBXA2R P21731 1/20 0.36
ADRA1A P35348 1/20 0.36
HTR2B P41595 1/20 0.36
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GABRA1 P14867 1/20 0.34
GABRB2 P47870 1/20 0.34
ALOX5 P09917 1/20 0.34
PTGS1 P23219 1/20 0.34
PTGS2 P35354 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
SCHEMBL44351 0.82 ALDH1A1 (0.62) ALDH1A1TRPA1CYP3A4LMNAHSD17B10
SCHEMBL2935032 0.82 DPP4 (0.52) ALDH1A1DPP4CYP3A4LMNAHSD17B10
SCHEMBL28812975 0.81 DPP4 (0.39) ALDH1A1DPP4TRPA1CYP3A4LMNA
SCHEMBL5677638 0.81 CYP3A4 (0.46) ALDH1A1DPP4TRPA1CYP3A4LMNA
SCHEMBL34164 0.81 DPP4 (0.39) ALDH1A1DPP4TRPA1CYP3A4LMNA
SCHEMBL3032868 0.81 ALDH1A1 (0.41) ALDH1A1DPP4TRPA1CYP3A4LMNA
SCHEMBL48082 0.81 ALDH1A1 (0.43) ALDH1A1DPP4TRPA1CYP3A4LMNA
SCHEMBL16338946 0.79 ALDH1A1 (0.42) ALDH1A1DPP4TRPA1CYP3A4LMNA
SCHEMBL3782116 0.77 CYP3A4 (0.43) ALDH1A1DPP4CYP3A4LMNAHSD17B10
SCHEMBL529908 0.77 HTR2B (0.39) ALDH1A1DPP4CYP3A4LMNAHSD17B10

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-11760762-B2 Thienopyranones and furanopyranones as kinase, bromodomain, and checkpoint inhibitors SIGNALRX PHARMACEUTICALS, INC. (US) 2023-09-19 US disclosed
US-11760762-B2 Thienopyranones and furanopyranones as kinase, bromodomain, and checkpoint inhibitors SIGNALRX PHARMACEUTICALS, INC. (US) 2023-09-19 US disclosed
WO-2020132603-A2 SALICYL-ADENOSINEMONOSULFAMATE ANALOGS AND USES THEREOF MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2020-06-25 WO disclosed
US-6759435-B1 SUCH AS METHYL-(1-(2-(1-PHENYL-ETHYL)-PHENYL)-ETHYL)-AMINE; SEROTONIN REUPTAKE INHIBITORS A.P. Group Inc. 2004-07-06 US disclosed
US-5047592-A Selective hydrogenolysis process ETHYL CORPORATION (US) 1991-09-10 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-11760762-B2 Thienopyranones and furanopyranones as kinase, bromodomain, and checkpoint inhibitors CDK1, CDKN1A, CDKL1 ALDH1A1 3077/4885DPP4 1899/4885TRPA1 2966/4885

“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.