SCHEMBL16242098

SCHEMBL16242098

C=CC(=O)Nc1ccc(COC)cc1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 15/20 0.63
▸ THRA P10827 1/20 0.57
▸ THRB P10828 1/20 0.57
▸ F13A1 P00488 6/20 0.54
▸ TGM1 P22735 6/20 0.54
▸ LMNA P02545 1/20 0.54
▸ TGM3 Q08188 1/20 0.54
▸ NPC1 O15118 1/20 0.43
▸ CASP3 P42574 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ SENP8 Q96LD8 1/20 0.43
▸ SENP7 Q9BQF6 1/20 0.43
▸ SENP6 Q9GZR1 1/20 0.43
▸ GPR55 Q9Y2T6 1/20 0.43
▸ FGFR1 P11362 1/20 0.42
▸ FGFR4 P22455 1/20 0.42

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
SCHEMBL16242097 0.85 TGM2 (0.56) TGM2THRATHRBF13A1TGM1
SCHEMBL29718235 0.82 TGM2 (0.61) TGM2THRATHRBF13A1TGM1
SCHEMBL30995086 0.81 TGM2 (0.59) TGM2THRATHRBF13A1TGM1
SCHEMBL1132464 0.81 THRA (0.67) TGM2THRATHRBF13A1TGM1
SCHEMBL10012411 0.81 TGM2 (0.51) TGM2THRATHRBF13A1TGM1
SCHEMBL440756 0.80 TGM2 (0.63) TGM2THRATHRBF13A1TGM1
SCHEMBL439369 0.80 TGM2 (0.79) TGM2THRATHRBF13A1TGM1
SCHEMBL3150538 0.79 SMN1; SMN2 (0.60) LMNARAB9A
SCHEMBL16685886 0.79 SMN1; SMN2 (0.49) LMNANPC1CASP3RAB9ASENP7
SCHEMBL16242100 0.79 TGM2 (0.61) TGM2THRATHRBF13A1TGM1

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-20140371459-A1 INDUSTRIAL PROCESS FOR PREPARATION OF 1,2-DIHYDROQUINOLINE DERIVATIVE OR A SALT THEREOF, AND INTERMEDIATE FOR PREPARATION THEREOF SANTEN PHARMACEUTICAL CO., LTD. (JP) 2014-12-18 — — US disclosed
EP-2805948-A1 INDUSTRIAL PROCESS FOR PREPARATION OF 1,2-DIHYDROQUINOLINE DERIVATIVE OR A SALT THEREOF, AND INTERMEDIATE FOR PREPARATION THEREOF Santen Pharmaceutical Co., Ltd (JP) 2014-11-26 — — EP 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-20140371459-A1 INDUSTRIAL PROCESS FOR PREPARATION OF 1,2-DIHYDROQUINOLINE DERIVATIVE OR A SALT THEREOF, AND INTERMEDIATE FOR PREPARATION THEREOF NR3C2, NR5A1, NR3C1 TGM2 3844/4885THRA 1193/4885THRB 771/4885

“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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