SCHEMBL6765711

SCHEMBL6765711

COc1cc2nc(N3CCCN(C(=O)N4CCC(F)CC4)CC3)cc(N)c2c(-c2ccccc2)c1OC

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CFD P00746 3/20 0.39
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
ALOX15 P16050 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 1/20 0.37
EZH2 Q15910 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.36
EHMT2 Q96KQ7 1/20 0.36

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
SCHEMBL6765566 0.91 AKR1C3 (0.45) KDM4ELMNAHSD17B10RAB9A
SCHEMBL6764902 0.88 KDM4E (0.40) CFDKDM4ELMNAALOX15NPSR1
SCHEMBL6765722 0.87 CNR2 (0.48) KDM4E
SCHEMBL8130257 0.86 EZH2 (0.42) KDM4EEZH2EHMT2
SCHEMBL4603370 0.85 AKR1C3 (0.41) CFDKDM4ELMNAHSD17B10MAPT
SCHEMBL6771618 0.85 CKS1B (0.52)
SCHEMBL7249486 0.84 AKR1C3 (0.40) CFDKDM4ELMNAHSD17B10MAPT
SCHEMBL6772466 0.84 AKR1C3 (0.46) KDM4EHSD17B10MAPTRAB9A
SCHEMBL6771678 0.83 AKR1C3 (0.40) KDM4EHSD17B10RAB9A
SCHEMBL6771632 0.83 AKR1C3 (0.41) KDM4EHSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6750214-B2 PARTICULARLY IN THE TREATMENT OF BENIGN PROSTATIC HYPERPLASIA COLLIS ALAN JOHN (US) 2004-06-15 US disclosed
US-20030220332-A1 Quinoline and quinazoline compounds useful in therapy PFIZER INC. 2003-11-27 US disclosed
US-6642242-B2 Antiproliferative agents to treat benign prostatic hyperplasia PFIZER INC. 2003-11-04 US disclosed
US-6103738-A Quinoline and quinazoline compounds useful in therapy PFIZER INC. (US) 2000-08-15 US disclosed
EP-0877734-B1 QUINOLINE AND QUINAZOLINE COMPOUNDS USEFUL IN THERAPY PFIZER RES & DEV (IE) 2000-07-12 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-20030220332-A1 Quinoline and quinazoline compounds useful in therapy NQO2, RFT1, ADRB3 CFD 3094/4885KDM4E 2944/4885LMNA 1011/4885

“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.