SCHEMBL16707263

SCHEMBL16707263

Cc1cc2c(Cl)ccnc2cc1OCCCN1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 9/20 0.56
EHMT1 Q9H9B1 9/20 0.56
CYP2D6 P10635 1/20 0.49
CYP2C19 P33261 1/20 0.49
HRH3 Q9Y5N1 1/20 0.48
SRC P12931 2/20 0.48
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 2/20 0.47
TSHR P16473 1/20 0.47
HTT P42858 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47

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
SCHEMBL2748129 0.87 EHMT2 (0.74) EHMT2EHMT1SRC
SCHEMBL8526894 0.86 EHMT2 (0.76) EHMT2EHMT1
SCHEMBL29636829 0.86 EHMT2 (0.76) EHMT2EHMT1
Hydrochloric Acid SCHEMBL6433786 0.85 EHMT2 (0.74) EHMT2EHMT1
SCHEMBL4664563 0.84 EHMT2 (0.52) EHMT2EHMT1HRH3SRCALDH1A1
SCHEMBL15960728 0.84 KDR (0.51) EHMT2EHMT1SRC
SCHEMBL10102456 0.82 EGFR (0.49) EHMT2EHMT1CYP2D6CYP2C19SRC
SCHEMBL15960726 0.81 TLR8 (0.40) EHMT2EHMT1SRCALDH1A1KDM4E
SCHEMBL11953085 0.81 EGFR (0.48) EHMT2EHMT1CYP2D6CYP2C19SRC
SCHEMBL2746706 0.80 EHMT2 (0.67) EHMT2EHMT1

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-20150133460-A1 LACTATE SALT OF 4-[6-METHOXY-7-(3-PIPERIDIN-1-YL-PROPOXY)QUINAZOLIN-4-YL]PIPERAZINE-1-CARBOXYLIC ACID(4-ISOPROPOXYPHENYL)-AMIDE AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF CANCER AND OTHER DISEASES OR DISORDERS MILLENNIUM PHAMACEUTICALS, INC. (US) 2015-05-14 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-20150133460-A1 LACTATE SALT OF 4-[6-METHOXY-7-(3-PIPERIDIN-1-YL-PROPOXY)QUINAZOLIN-4-YL]PIPERAZINE-1-CARBOXYLIC ACID(4-ISOPROPOXYPHENYL)-AMIDE AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF CANCER AND OTHER DISEASES OR DISORDERS GLS, GLS2, GOT2 EHMT2 4355/4885EHMT1 4429/4885CYP2D6 856/4885

“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.