SCHEMBL15412100

SCHEMBL15412100

CCc1c2ccccc2c(CC)c2c(C)c(C)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 5/20 0.41
▸ CYP1A2 P05177 3/20 0.41
▸ CYP2A6 P11509 1/20 0.41
▸ HTT P42858 2/20 0.35
▸ HPGD P15428 5/20 0.33
▸ CYP3A4 P08684 4/20 0.33
▸ HSD17B10 Q99714 4/20 0.33
▸ HIF1A Q16665 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ CASP7 P55210 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ NOS3 P29474 1/20 0.32
▸ NOS2 P35228 1/20 0.32
▸ KDM4E B2RXH2 5/20 0.32
▸ ALDH1A1 P00352 4/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TP53 P04637 2/20 0.32

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
SCHEMBL20915583 0.80 CYP1A2 (0.35) CYP1A2HTTHPGDNOS3NOS2
SCHEMBL11577554 0.77 CYP1A2 (0.47) TSHRCYP1A2CYP2A6HTTHPGD
SCHEMBL3731188 0.76 TP53 (0.41) TSHRCYP1A2HTTHPGDMAPK1
SCHEMBL2317562 0.76 TP53 (0.45) TSHRCYP1A2CYP2A6HTTHPGD
SCHEMBL29853674 0.76 TP53 (0.45) TSHRCYP1A2CYP2A6HTTHPGD
SCHEMBL3766413 0.75 BCL2 (0.39) TSHRCYP1A2CYP2A6RAB9AALDH1A1
SCHEMBL7629059 0.74 HSD17B10 (0.47) TSHRCYP1A2CYP2A6HPGDCYP3A4
SCHEMBL29177997 0.72 CYP1A2 (0.52) TSHRCYP1A2CYP2A6HTTHPGD
SCHEMBL28275472 0.70 TP53 (0.41) TSHRCYP1A2CYP2A6HTTHPGD
SCHEMBL21940785 0.69 ACHE (0.37) TSHRCYP1A2CYP2A6HTTHPGD

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-9394221-B2 Method for manufacturing benzenetetracarboxylic acid JX NIPPON OIL & ENERGY COMPANY (JP) 2016-07-19 — — US disclosed
US-20140018569-A1 METHOD FOR MANUFACTURING BENZENETETRACARBOXYLIC ACID JX NIPPON OIL & ENERGY CORPORATION (JP) 2014-01-16 — — 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-20140018569-A1 METHOD FOR MANUFACTURING BENZENETETRACARBOXYLIC ACID HAAO, HAO2, HPD TSHR 970/4885CYP1A2 190/4885CYP2A6 67/4885

“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.

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