SCHEMBL17138149

SCHEMBL17138149

CCCC(C)COc1cccc(OCC(C)CCC)c1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.49
GPBAR1 Q8TDU6 1/20 0.47
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
MTNR1A P48039 3/20 0.43
MTNR1B P49286 3/20 0.43
ADRB2 P07550 1/20 0.43
ADRB1 P08588 1/20 0.43
GPR88 Q9GZN0 8/20 0.42
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL13879749 0.91 ADRB2 (0.54) TSHRADRB2ADRB1
SCHEMBL27330236 0.86 LMNA (0.57) GPR88
SCHEMBL2561288 0.84 ENPP2 (0.50) HIF1AADRB2ADRB1GPR88
SCHEMBL6281442 0.84 HIF1A (0.40) HIF1AGPBAR1TSHRMAPK1ADRB2
SCHEMBL17138170 0.84 GPBAR1 (0.60) HIF1AGPBAR1TSHRMAPK1MTNR1A
SCHEMBL201166 0.82 PARP1 (0.53) ADRB2ADRB1GPR88
SCHEMBL19291801 0.81 TAAR1 (0.44) GPR88
SCHEMBL17138148 0.79 HIF1A (0.47) HIF1AGPBAR1TSHRMAPK1MTNR1A
SCHEMBL14595237 0.78 TSHR (0.59) HIF1AGPBAR1TSHRMAPK1MTNR1A
SCHEMBL2967940 0.77 TRIM24 (0.55) HIF1ATSHRMAPK1MTNR1AMTNR1B

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-20150283051-A1 DERIVATIVE OF NOVEL POLYHYDROXY AROMATIC COMPOUND AND USE THEREOF RNS CO.,LTD. (KR) 2015-10-08 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-20150283051-A1 DERIVATIVE OF NOVEL POLYHYDROXY AROMATIC COMPOUND AND USE THEREOF HRH3, CBR3, H1-0 HIF1A 375/4885GPBAR1 3596/4885TSHR 4026/4885

“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.