SCHEMBL6765722

SCHEMBL6765722

COc1cc2nc(N3CCCN(C(=O)C4CCOCC4)CC3)cc(N)c2c(-c2ccccc2)c1OC

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.48
CKS1B P61024 1/20 0.39
SKP1 P63208 1/20 0.39
SKP2 Q13309 1/20 0.39
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL8130257 0.92 EZH2 (0.42) CNR2CKS1BSKP1SKP2KDM4E
SCHEMBL6765566 0.89 AKR1C3 (0.45) CNR2KDM4E
SCHEMBL6765711 0.87 CFD (0.39) KDM4E
SCHEMBL6764902 0.85 KDM4E (0.40) CKS1BSKP1SKP2KDM4E
SCHEMBL6771618 0.83 CKS1B (0.52) CKS1BSKP1SKP2
SCHEMBL6767219 0.82 ALDH1A1 (0.51) KDM4E
SCHEMBL6772466 0.82 AKR1C3 (0.46) CNR2KDM4E
SCHEMBL6771632 0.81 AKR1C3 (0.41) CNR2KDM4E
SCHEMBL4603370 0.81 AKR1C3 (0.41) CNR2KDM4E
SCHEMBL7249486 0.81 AKR1C3 (0.40) CNR2KDM4E

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 6 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-20020049322-A1 Quinoline and quinazoline compounds useful in therapy COLLIS ALAN JOHN (GB) 2002-04-25 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 (2 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-20020049322-A1 Quinoline and quinazoline compounds useful in therapy NQO2, RFT1, IDH3B CNR2 512/4885CKS1B 419/4885SKP1 1068/4885
US-20030220332-A1 Quinoline and quinazoline compounds useful in therapy NQO2, RFT1, ADRB3 CNR2 517/4885CKS1B 441/4885SKP1 1069/4885

“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.