SCHEMBL5860645

SCHEMBL5860645

CCC(Oc1ccc(/C=C/c2cc(-c3ccc(Cl)cc3)oc2C)cc1C)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
PPARA Q07869 9/20 0.41
PPARG P37231 6/20 0.39
TSHR P16473 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39
S100A4 P26447 1/20 0.39
MMP1 P03956 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
PPARD Q03181 2/20 0.37
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PKM P14618 1/20 0.36
MAPT P10636 1/20 0.35
HPGD P15428 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
SCHEMBL5860649 1.00 NPC1 (0.44) NPC1RAB9APPARAPPARGTSHR
SCHEMBL6164976 0.82 PPARD (0.49) NPC1RAB9APPARAPPARGTSHR
SCHEMBL6164979 0.82 PPARD (0.49) NPC1RAB9APPARAPPARGTSHR
SCHEMBL5860930 0.79 PPARA (0.41) NPC1RAB9APPARAPPARGTSHR
SCHEMBL5861876 0.78 PTGER4 (0.51) NPC1RAB9APPARAPPARGSMN1; SMN2
SCHEMBL2210931 0.75 TSHR (0.66) PPARAPPARGTSHRHTR2AHTR2C
SCHEMBL2597640 0.75 TSHR (0.66) PPARAPPARGTSHRHTR2AHTR2C
Dimethylamine SCHEMBL28258492 0.72 TSHR (0.61) PPARAPPARGTSHRHTR2AHTR2C
SCHEMBL5862831 0.72 PPARA (0.41) PPARAPPARGTSHRHTR2AHTR2C
SCHEMBL5861087 0.72 PPARD (0.41) PPARAPPARGTSHRHTR2AHTR2C

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7091237-B2 Furan and thiophene derivatives that activate human peroxisome proliferator activated receptors SMITHKLINE BEECHAM CORPORATION (US) 2006-08-15 US disclosed
US-20040157890-A1 Furan and thiophene derivatives that activate human peroxisome profilerator activated receptors GLAXO GROUP LIMITED (GB) 2004-08-12 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-20040157890-A1 Furan and thiophene derivatives that activate human peroxisome profilerator activated receptors PPARG, PPARD, PPARA NPC1 247/4885RAB9A 2352/4885PPARA 3/4885

“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.