SCHEMBL3234033

SCHEMBL3234033

c1ccc2c(c1)OCc1c-2ccc2cncnc12

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.40
THRB P10828 1/20 0.39
PGR P06401 1/20 0.37
MAOB P27338 9/20 0.36
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 4/20 0.35
ATM Q13315 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALPL P05186 1/20 0.35
HSD17B10 Q99714 1/20 0.35
EGFR P00533 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
SCHEMBL21358547 0.78 PNMT (0.38) PGRKDM4EALDH1A1LMNAMAPT
SCHEMBL31037875 0.71 MAOA (0.44) MAOBLMNAGAASMN1; SMN2EGFR
SCHEMBL25850566 0.70 EGFR (0.48) KDM4ELMNAMAPTSMN1; SMN2EGFR
SCHEMBL30565305 0.65 EGFR (0.52) KMT2ATHRBKDM4EALDH1A1GAA
SCHEMBL3074807 0.65 EGFR (0.50) KDM4EALDH1A1LMNAGAAMAPT
SCHEMBL1047930 0.65 MAPT (0.44) KMT2ATHRBPGRMAOBKDM4E
SCHEMBL25304193 0.63 MAOA (0.44) KMT2AMAOBKDM4EALDH1A1LMNA
SCHEMBL17453005 0.63 ROCK2 (0.51) KMT2AMAOBKDM4EALDH1A1MAPT
SCHEMBL20482144 0.63 ADRA2A (0.33) EGFR
SCHEMBL596668 0.62 CCR1 (0.67) KDM4EALDH1A1LMNAMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2116538-B1 CONDENSED TETRAHYDROQUINOLINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES MITSUBISHI TANABE PHARMA CORP (JP) 2013-03-27 EP disclosed
US-8367695-B2 Condensed tetrahydroquinoline derivative and use thereof for medical purposes MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-02-05 US disclosed
US-20100063055-A1 CONDENSED TETRAHYDROQUINOLINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-03-11 US disclosed
EP-2116538-A1 CONDENSED TETRAHYDROQUINOLINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES Mitsubishi Tanabe Pharma Corporation (JP) 2009-11-11 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-20100063055-A1 CONDENSED TETRAHYDROQUINOLINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES NR3C2, MC2R, NR5A1 KMT2A 961/4885THRB 324/4885PGR 11/4885

“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.