SCHEMBL7245357

SCHEMBL7245357

COc1ccc2c(c1)CCC(Cc1ccccc1)C2=O

nearest known ligand 0.80

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP24A1 Q07973 6/20 0.80
CYP26A1 O43174 5/20 0.80
CYP19A1 P11511 3/20 0.80
CYP27A1 Q02318 3/20 0.76
DRD2 P14416 2/20 0.60
HTR2A P28223 2/20 0.60
HTR2C P28335 2/20 0.60
HTR2B P41595 2/20 0.60
SIGMAR1 Q99720 2/20 0.60
ACHE P22303 2/20 0.56

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
SCHEMBL7249809 0.90 CYP19A1 (0.80) CYP24A1CYP26A1CYP19A1CYP27A1DRD2
SCHEMBL6827615 0.89 CYP19A1 (1.00) CYP24A1CYP26A1CYP19A1CYP27A1
SCHEMBL8159828 0.89 CYP26A1 (0.78) CYP24A1CYP26A1CYP19A1CYP27A1DRD2
SCHEMBL5582351 0.88 CYP19A1 (0.77) CYP24A1CYP26A1CYP19A1CYP27A1ACHE
SCHEMBL6822323 0.87 CYP19A1 (0.76) CYP24A1CYP26A1CYP19A1CYP27A1DRD2
SCHEMBL8203668 0.87 CYP26A1 (0.79) CYP24A1CYP26A1CYP19A1CYP27A1ACHE
SCHEMBL4623145 0.87 CYP24A1 (0.66) CYP24A1CYP26A1CYP19A1CYP27A1DRD2
SCHEMBL28733982 0.85 CYP24A1 (0.66) CYP24A1CYP26A1CYP19A1CYP27A1SIGMAR1
SCHEMBL29679457 0.85 CYP24A1 (0.66) CYP24A1CYP26A1CYP19A1CYP27A1SIGMAR1
SCHEMBL15874727 0.85 CYP24A1 (0.66) CYP24A1CYP26A1CYP19A1CYP27A1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030191279-A1 Urea derivatives useful as anticancer agents GOLDSTEIN STEVEN WAYNE (US) 2003-10-09 US disclosed
US-6133286-A ANTAGONISTS; ANTIINFLAMMATORY AGENTS FOR RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, INFLAMMATORY BOWEL DISEASE, PSORIASIS AND OTHER SKIN DISORDERS, E.G., ECZEMA, ERYTHEMA, PRURITUS AND ACNE; STROKE, REPERFUSION INJURY, GRAFTING PFIZER INC. (US) 2000-10-17 US disclosed
US-6117874-A AROMATIC RING-SUBSTITUTED 4-HYDROXYTETRAHYDROQUINOLINES PFIZER INC. (US) 2000-09-12 US disclosed
US-6051601-A USEFUL OF INFLAMMATORY DISORDERS INCLUDING RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, INFLAMMATORY BOWEL DISEASE, PSORIASIS AND OTHER SKIN DISORDERS SUCH AS ECZEMA, ERYTHEMA, PRURITUS AND ACNE, STROKE AND OTHER FORMS OF REPERFUSLON PFIZER INC. (US) 2000-04-18 US disclosed
US-5939452-A TREATMENT OF ANTIINFLAMMATORY SKIN DISORDERS, AUTOIMMUNE DISORDERS PFIZER INC (US) 1999-08-17 US disclosed
EP-0785935-A1 BENZOPYRAN AND BENZO-FUSED COMPOUNDS, THEIR PREPARATION AND THEIR USE AS LEUKOTRIENE B4' (LTB4) ANTAGONISTS PFIZER INC. (US) 1997-07-30 EP disclosed
EP-0785930-A1 BENZOPYRAN AND BENZO-FUSED COMPOUNDS, THEIR PREPARATION AND THEIR USE AS LEUKOTRIENE B 4? (LTB 4?) ANTAGONISTS PFIZER INC. (US) 1997-07-30 EP disclosed
WO-1996011925-A1 BENZOPYRAN AND BENZO-FUSED COMPOUNDS, THEIR PREPARATION AND THEIR USE AS LEUKOTRIENE B4' (LTB4) ANTAGONISTS PFIZER INC. (US) 1996-04-25 WO disclosed
WO-1996011920-A1 BENZOPYRAN AND BENZO-FUSED COMPOUNDS, THEIR PREPARATION AND THEIR USE AS LEUKOTRIENE B4 (LTB4) ANTAGONISTS PFIZER INC. (US) 1996-04-25 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-20030191279-A1 Urea derivatives useful as anticancer agents CCNA1, CCNE1, CCND1 CYP24A1 1214/4885CYP26A1 2627/4885CYP19A1 2314/4885

“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.