SCHEMBL2200054

SCHEMBL2200054

SNc1cccc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
TSHR P16473 4/20 0.56
HSD17B10 Q99714 4/20 0.56
HPGD P15428 3/20 0.56
CYP3A4 P08684 2/20 0.56
TP53 P04637 1/20 0.56
ALOX15 P16050 1/20 0.56
CDC25B P30305 1/20 0.56
ATM Q13315 1/20 0.56
KDM4E B2RXH2 4/20 0.52
GAA P10253 2/20 0.52
CA12 O43570 2/20 0.50
CA14 Q9ULX7 2/20 0.50
FADS1 O60427 1/20 0.50
KEAP1 Q14145 1/20 0.50
CA3 P07451 1/20 0.50
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
CA5A P35218 1/20 0.50
CA7 P43166 1/20 0.50

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
SCHEMBL7915675 0.79 ALDH1A1 (0.60) ALDH1A1TSHRHSD17B10HPGDCYP3A4
SCHEMBL49213 0.79 HSD17B10 (0.74) ALDH1A1TSHRHSD17B10HPGDCYP3A4
SCHEMBL8500339 0.77 HSD17B10 (0.71) ALDH1A1TSHRHSD17B10HPGDCYP3A4
Ammonia Solution, Strong SCHEMBL11586421 0.77 HSD17B10 (0.71) ALDH1A1TSHRHSD17B10HPGDCYP3A4
SCHEMBL1921580 0.77 HSD17B10 (0.71) ALDH1A1TSHRHSD17B10HPGDCYP3A4
SCHEMBL16687465 0.76 CA12 (0.67) ALDH1A1TSHRHSD17B10HPGDCYP3A4
SCHEMBL7483801 0.75 ALDH1A1 (0.56) ALDH1A1TSHRHSD17B10HPGDCYP3A4
SCHEMBL294429 0.75 ALDH1A1 (0.56) ALDH1A1TSHRHSD17B10HPGDCYP3A4
SCHEMBL316073 0.75 KDM4E (0.57) ALDH1A1TSHRHSD17B10HPGDCYP3A4
SCHEMBL9370129 0.75 ALDH1A1 (0.56) ALDH1A1TSHRHSD17B10HPGDCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1909142-B1 PHOTOSENSITIVE RESIN COMPOSITION AND ADHESION ENHANCER TORAY INDUSTRIES (JP) 2015-06-24 EP disclosed
US-7977028-B2 Photosensitive resin composition and adhesion promoter TORAY INDUSTRIES, INC. (JP) 2011-07-12 US disclosed
US-20090123867-A1 PHOTOSENSITIVE RESIN COMPOSITION AND ADHESION PROMOTER TORAY INDUSTRIES, INC. (JP) 2009-05-14 US disclosed
EP-1909142-A1 PHOTOSENSITIVE RESIN COMPOSITION AND ADHESION ENHANCER TORAY INDUSTRIES, INC. (JP) 2008-04-09 EP disclosed
EP-0505385-A4 ANTI-AGGREGATORY PEPTIDES CONTAINING A MERCAPTAN OR SULFIDE MOIETY 1993-05-05 EP disclosed
EP-0505385-A1 ANTI-AGGREGATORY PEPTIDES CONTAINING A MERCAPTAN OR SULFIDE MOIETY SMITHKLINE BEECHAM CORPORATION (US) 1992-09-30 EP disclosed
WO-1991007429-A1 ANTI-AGGREGATORY PEPTIDES CONTAINING A MERCAPTAN OR SULFIDE MOIETY SMITHKLINE BEECHAM CORPORATION (US) 1991-05-30 WO disclosed
US-3972890-A ACID CATALYST BAYER AKTIENGESELLSCHAFT (DT) 1976-08-03 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-20090123867-A1 PHOTOSENSITIVE RESIN COMPOSITION AND ADHESION PROMOTER PCNA, TERB1, SMC2 ALDH1A1 1144/4885TSHR 4306/4885HSD17B10 4260/4885

“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.