SCHEMBL7337197

SCHEMBL7337197

COc1ccc2ccc(C#N)cc2c1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
ACLY P53396 2/20 0.37
CFB P00751 5/20 0.37
AR P10275 2/20 0.36
NCEH1 Q6PIU2 1/20 0.36
ALPL P05186 2/20 0.36
NR3C1 P04150 2/20 0.36
PGR P06401 2/20 0.36
NR3C2 P08235 2/20 0.36
AKR1C3 P42330 1/20 0.36
ACHE P22303 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35

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
SCHEMBL1398164 0.81 AR (0.48) PDE4APDE4CPDE4DACLYAR
SCHEMBL7337530 0.79 AR (0.46) ARNCEH1ACHECA1CA2
SCHEMBL3469412 0.79 MAPT (0.47) PDE4APDE4CPDE4D
SCHEMBL6700942 0.75 PDE4A (0.42) PDE4APDE4CPDE4DNCEH1AKR1C3
SCHEMBL16179448 0.74 MRGPRX4 (0.42) PDE4APDE4CPDE4DARAKR1C3
SCHEMBL1195899 0.74 HSD11B1 (0.45) PDE4APDE4CPDE4DAKR1C3CA1
SCHEMBL7343640 0.74 AR (0.43) ARNCEH1NR3C1PGRNR3C2
SCHEMBL30916458 0.74 LMNA (0.37) PDE4APDE4CPDE4DACLYCFB
SCHEMBL7340884 0.73 HPGD (0.53)
SCHEMBL5728291 0.73 EPAS1 (0.45) PDE4APDE4CPDE4DAKR1C3

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-6358995-B1 AGONIST FOR RETINOIC ACID RECEPTORS; CAN BE SUBSTITUTED FOR RETINOIC ACID AS PREVENTIVE AND THERAPEUTIC DRUGS FOR VARIOUS DISEASES OR CANCERS, SUCH AS ACUTE PROMYELOCYTIC LEUKEMIA. EISAI CO., LTD. (JP) 2002-03-19 US disclosed
US-20010049374-A1 Urokinase inhibitors STEELE ANDREW W (US) 2001-12-06 US disclosed
US-6284796-B1 NAPHTHAMIDINE COMPOUNDS ABBOTT LABORATORIES 2001-09-04 US disclosed
US-6258822-B1 ENZYME INHIBITORS OF NAPHTHALENE AMIDINE COMPOUNDS ABBOTT LABORATORIES 2001-07-10 US disclosed
US-6121309-A SUCH AS 4-(2-(5-(7-FLUORO-4-TRIFLUOROMETHYLBENZOFURAN-2-YL)PYRROLYL)) BENZOIC ACID; RETINOIC ACID RECEPTOR AGONISM EISAI CO., LTD. (JP) 2000-09-19 US disclosed
US-6110959-A A RETINOIC ACID RECEPTOR AGONIST EISAI CO., LTD. (JP) 2000-08-29 US disclosed
EP-1000018-A2 UROKINASE INHIBITORS Abbott Laboratories (US) 2000-05-17 EP disclosed
WO-1999005096-A2 UROKINASE INHIBITORS ABBOTT LABORATORIES (US) 1999-02-04 WO disclosed
EP-0889032-A1 FUSED-RING CARBOXYLIC ACID DERIVATIVES Eisai Co., Ltd. (JP) 1999-01-07 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-20010049374-A1 Urokinase inhibitors SERPINE1, PLAU, SERPINB1 PDE4A 2907/4885PDE4C 3046/4885PDE4D 3657/4885

“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.