SCHEMBL3378385

SCHEMBL3378385

COc1cc(CS(=O)(=O)NCc2ccc(C(=O)O)cc2)ccc1-c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 1/20 0.48
TSHR P16473 1/20 0.48
CNR1 P21554 1/20 0.47
PPARG P37231 1/20 0.46
PPARD Q03181 1/20 0.46
PPARA Q07869 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
SRD5A2 P31213 1/20 0.45
ADRB1 P08588 1/20 0.44
ADRB3 P13945 1/20 0.44
AVPR1A P37288 1/20 0.44
PTGER4 P35408 1/20 0.44
HTT P42858 1/20 0.44
OPRK1 P41145 1/20 0.43
TTR P02766 1/20 0.43
LPAR1 Q92633 1/20 0.43
LPAR5 Q9H1C0 1/20 0.43

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
SCHEMBL3380135 0.84 SRD5A2 (0.57) TSHRSRD5A2OPRK1
SCHEMBL3375868 0.80 PTGER4 (0.46) TSHRPPARAPTGER4
SCHEMBL3376266 0.78 FEN1 (0.42) FABP4TSHRPTGER4LPAR1LPAR5
SCHEMBL3378390 0.78 FFAR4 (0.43) TSHRPPARGPPARDPPARASRD5A2
SCHEMBL27811168 0.77 TSHR (0.73) FABP4TSHRSMN1; SMN2LMNAMAPT
SCHEMBL3376011 0.76 SRD5A2 (0.45) SRD5A2
SCHEMBL3376139 0.75 KMT2A (0.47) TSHRSRD5A2OPRK1
SCHEMBL3379986 0.72 CA12 (0.41) PPARASRD5A2HTT
SCHEMBL14635922 0.69 HPGD (0.51) FABP4LMNA
SCHEMBL6536178 0.69 SMN1; SMN2 (0.59) TSHRSMN1; SMN2LMNAMAPTHTT

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-8389500-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2013-03-05 US claimed
WO-2010056527-A2 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-20 WO claimed
US-20100113449-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-06 US claimed
US-8389500-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2013-03-05 US disclosed
US-20100113449-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-06 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-20100113449-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS KCNJ2, HCN4, KCNH2 FABP4 1067/4885TSHR 3437/4885CNR1 484/4885

“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.