SCHEMBL3582905

SCHEMBL3582905

CC(C)(C)OC(=O)NCC(CO)NC(=O)OCc1ccccc1

nearest known ligand 0.82

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.82
CTSK P43235 8/20 0.52
ATM Q13315 1/20 0.52
CTRB1 P17538 2/20 0.51
CTSS P25774 9/20 0.51
CTSL P07711 6/20 0.51
CTSB P07858 4/20 0.51
PPARA Q07869 1/20 0.49
MAPT P10636 1/20 0.48

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
SCHEMBL2627375 1.00 SYK (0.82) SYKCTSKATMCTRB1CTSS
SCHEMBL3271846 1.00 SYK (0.82) SYKCTSKATMCTRB1CTSS
SCHEMBL14497009 0.95 SYK (0.74) SYKCTSKATMCTRB1CTSS
SCHEMBL30489620 0.95 SYK (0.74) SYKCTSKATMCTRB1CTSS
SCHEMBL28668267 0.95 SYK (0.74) SYKCTSKATMCTRB1CTSS
SCHEMBL6310853 0.90 SYK (0.82) SYKCTSKATMCTRB1CTSS
SCHEMBL6310847 0.90 SYK (0.82) SYKCTSKATMCTRB1CTSS
SCHEMBL2627398 0.90 SYK (1.00) SYKCTSKATMCTRB1CTSS
SCHEMBL6310843 0.90 SYK (0.82) SYKCTSKATMCTRB1CTSS
SCHEMBL20674340 0.89 SYK (0.80) SYKCTSKATMCTRB1CTSS

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-7728005-B2 Ether derivative AJINOMOTO CO., INC. (JP) 2010-06-01 US disclosed
US-20060270693-A1 Ether derivative AJINOMOTO CO., INC. (JP) 2006-11-30 US disclosed
EP-1679296-A1 ETHER DERIVATIVE Ajinomoto Co., Inc. (JP) 2006-07-12 EP disclosed
EP-1080069-B1 ANTHRANILIC ACID DERIVATIVES AS INHIBITORS OF THE CGMP-PHOSPHODIESTERASE FUJISAWA PHARMACEUTICAL CO (JP) 2003-03-19 EP disclosed
US-20020193614-A1 Anthranilic acid derivatives as inhibitors of the CGMP-phosphodiesterase FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2002-12-19 US disclosed
US-6384080-B1 TREATMENT AND/OR PREVENTION OF CERTAIN CARDIOVASCULAR DISORDERS, UROGENITAL DISORDERS, RESPIRATORY SYSTEM DISORDERS, DISORDERS OF GUT MOTILITY, SEXUAL DISORDERS, DIABETIC COMPLICATIONS, URTICARIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-05-07 US disclosed
CN-1305454-A Anthranilic acid derivatives as inhibitors of CGMP phosphodiesterase FUJISAWA PHARMACEUTICAL CO (JP) 2001-07-25 CN disclosed
EP-1080069-A1 ANTHRANILIC ACID DERIVATIVES AS INHIBITORS OF THE CGMP-PHOSPHODIESTERASE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-03-07 EP disclosed
WO-1999054284-A1 ANTHRANILIC ACID DERIVATIVES AS INHIBITORS OF THE CGMP-PHOSPHODIESTERASE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-10-28 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 (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-20020193614-A1 Anthranilic acid derivatives as inhibitors of the CGMP-phosphodiesterase PDE3A, PDE2A, PDE5A SYK 715/4885CTSK 2213/4885ATM 387/4885
US-20060270693-A1 Ether derivative UROD, IL5, IL17A SYK 1719/4885CTSK 3314/4885ATM 4594/4885

“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.