SCHEMBL6770087

SCHEMBL6770087

CC(C)(O)c1cc(-c2cccc(Cl)c2)ccc1N

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PGR P06401 4/20 1.00
ESR2 Q92731 1/20 0.46
ALOX5 P09917 1/20 0.46
TAAR1 Q96RJ0 2/20 0.45
BACE1 P56817 1/20 0.42
MAOB P27338 2/20 0.41
JAK2 O60674 1/20 0.41
MAP4K4 O95819 3/20 0.40
CNR2 P34972 1/20 0.39
IKBKE Q14164 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
SCHEMBL4367637 0.83 PGR (0.70) PGRESR2ALOX5TAAR1BACE1
SCHEMBL18874465 0.81 PGR (0.67) PGR
SCHEMBL6013810 0.81 PGR (0.67) PGRESR2ALOX5TAAR1MAOB
SCHEMBL4357762 0.80 PGR (0.67) PGRESR2ALOX5TAAR1BACE1
SCHEMBL4540489 0.79 PGR (0.65) PGRESR2ALOX5TAAR1BACE1
SCHEMBL10802069 0.76 PGR (0.61) PGRESR2ALOX5TAAR1MAOB
SCHEMBL4352812 0.76 PGR (0.60) PGRESR2ALOX5TAAR1BACE1
SCHEMBL5844964 0.74 ALOX5 (0.69) PGRESR2ALOX5TAAR1BACE1
SCHEMBL7969111 0.73 CYP3A4 (0.68) PGRESR2ALOX5TAAR1BACE1
Methane SCHEMBL11773808 0.72 CYP3A4 (0.65) PGRESR2ALOX5TAAR1BACE1

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-6693103-B2 CONTRACEPTION, TREATMENT OF FIBROIDS, ANTICARCINOGENIC AND -TUMOR AGENTS (ENDOMETRIOSIS, BREAST, UTERINE, OVARIAN AND PROSTATE CANCER), AND POST MENOPAUSAL HORMONE REPLACEMENT THERAPY; BENIGN PROSTATIC HYPERTROPHY; ADENOCARCINOMAS WYETH 2004-02-17 US disclosed
US-20020094983-A1 Quinazolinone and benzoxazine derivatives as progesterone receptor modulators LIGAND PHARMACEUTICALS INCORPORATED 2002-07-18 US disclosed
US-6358948-B1 ANTICARCINOGENIC AND ANTITUMOR AGENTS AGAINST BREAST, PITUITARY, OVARIAN, ENDOMETRIUM, AND PROSTATE CANCER; BENIGN PROSTATIC HYPERPLASIA; CONTRACEPTIVES AMERICAN HOME PRODUCTS CORPORATION 2002-03-19 US disclosed
EP-1175404-A1 QUINAZOLINONE AND BENZOXAZINE DERIVATIVES AS PROGESTERONE RECEPTOR MODULATORS American Home Products Corporation (US) 2002-01-30 EP disclosed
WO-2000066560-A1 QUINAZOLINONE AND BENZOXAZINE DERIVATIVES AS PROGESTERONE RECEPTOR MODULATORS AMERICAN HOME PRODUCTS CORPORATION (US) 2000-11-09 WO 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-20020094983-A1 Quinazolinone and benzoxazine derivatives as progesterone receptor modulators PGR, NR3C1, NR3C2 PGR 1/4885ESR2 45/4885ALOX5 2794/4885

“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.