SCHEMBL1702377

SCHEMBL1702377

CNNc1ccc(Cl)c(O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 3/20 0.46
▸ TSHR P16473 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ CYP3A4 P08684 2/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ MAPT P10636 2/20 0.43
▸ GLA P06280 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ RET P07949 1/20 0.38
▸ KIF5B P33176 1/20 0.38
▸ KDR P35968 1/20 0.38
▸ HPGD P15428 1/20 0.36
▸ MAOB P27338 1/20 0.35
▸ EPHX1 P07099 1/20 0.35
▸ EPHX2 P34913 1/20 0.35
▸ RIPK2 O43353 1/20 0.35
▸ EGFR P00533 1/20 0.35
▸ TGFBR1 P36897 1/20 0.35
▸ APEX1 P27695 1/20 0.34
▸ NPC1 O15118 1/20 0.34

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
SCHEMBL14817944 0.83 TSHR (0.46) HSD17B10TSHRALDH1A1MAPTGLA
SCHEMBL15934314 0.83 HSD17B10 (0.50) HSD17B10TSHRALDH1A1CYP3A4TDP1
SCHEMBL7568541 0.81 HSD17B10 (0.48) HSD17B10TSHRALDH1A1CYP3A4TDP1
Hydrochloric Acid SCHEMBL8073459 0.79 HSD17B10 (0.46) HSD17B10TSHRALDH1A1CYP3A4TDP1
SCHEMBL6321756 0.79 HSD17B10 (0.46) HSD17B10TSHRALDH1A1CYP3A4TDP1
Hydrochloric Acid SCHEMBL4679683 0.78 HSD17B10 (0.45) HSD17B10TSHRALDH1A1CYP3A4TDP1
SCHEMBL25877303 0.77 ABL1 (0.50) ALDH1A1CYP3A4MAPTGLAGAA
SCHEMBL19049142 0.73 ALDH1A1 (0.59) ALDH1A1CYP3A4MAPTGAAKDR
SCHEMBL19112588 0.72 TUBB1 (0.50) TSHRALDH1A1CYP3A4MAPTGAA
SCHEMBL9815484 0.72 PKM (0.59) TSHRALDH1A1CYP3A4TDP1MAPT

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-20120088763-A1 TRIAZOLOPYRIDINE DERIVATIVES AND THEIR THERAPEUTIC USE CHIESI FARMACEUTICI S.P.A. (IT) 2012-04-12 — — 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-20120088763-A1 TRIAZOLOPYRIDINE DERIVATIVES AND THEIR THERAPEUTIC USE CNKSR1, MOK, MAPK1 HSD17B10 3878/4885TSHR 565/4885ALDH1A1 1860/4885

“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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