SCHEMBL1854038

SCHEMBL1854038

CCCCCCC#Cc1ccc(C=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.55
FFAR4 Q5NUL3 1/20 0.55
MMP2 P08253 1/20 0.54
MMP12 P39900 1/20 0.54
KCNH2 Q12809 5/20 0.45
ALDH1A1 P00352 4/20 0.43
CYP3A4 P08684 3/20 0.43
CYP2C19 P33261 1/20 0.43
TNK2 Q07912 1/20 0.40
GPR84 Q9NQS5 1/20 0.39
TSHR P16473 1/20 0.39
MAPT P10636 2/20 0.38
HPGD P15428 2/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH3A1 P30838 1/20 0.38
ALDH1A3 P47895 1/20 0.38
GGPS1 O95749 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALOX12 P18054 1/20 0.37

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
SCHEMBL1856283 1.00 FFAR1 (0.55) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL1854843 1.00 FFAR1 (0.55) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL2233459 0.98 FFAR1 (0.52) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL6087379 0.93 FFAR1 (0.47) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL3062130 0.89 FFAR1 (0.43) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL8310043 0.86 ALDH1A1 (0.42) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL5886652 0.86 FFAR1 (0.63) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL31497568 0.83 MMP2 (0.40) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL7680519 0.81 KCNH2 (0.48) FFAR1FFAR4MMP2MMP12KCNH2
SCHEMBL1852576 0.81 KCNH2 (0.48) FFAR1FFAR4MMP2MMP12KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114340605-A Rationally designed lawsone derivatives as antibacterial agents against multidrug-resistant Staphylococcus aureus 肯特州立大学 2022-04-12 CN disclosed
EP-1470102-B1 SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) MERCK SERONO SA (CH) 2011-05-25 EP disclosed
US-7592477-B2 Substituted methylene amide derivatives as modulators of protein tyrosine phosphatases (PTPs) LABORATOIRES SERONO SA (CH) 2009-09-22 US disclosed
US-20050124656-A1 Substituted methylene amide derivatives as modulators of protein tyrosine phosphatases(ptps) APPLIED RESEARCH SYSTEMS ARS (NL) 2005-06-09 US disclosed
EP-1470102-A1 SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) Applied Research Systems ARS Holding N.V. (AN) 2004-10-27 EP disclosed
WO-2003064376-A1 SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2003-08-07 WO disclosed
EP-0195097-B1 ARACHIDONIC ACID ANALOGUES, PROCESSES FOR THEIR PREPARATION AND THEIR USE IN MEDICINE BEECHAM GROUP PLC (GB) 1987-10-28 EP disclosed
US-4699995-A ANTIALLERGENS BEECHAM GROUP P.L.C. (GB) 1987-10-13 US disclosed
EP-0142145-B1 ARACHIDONIC ACID ANALOGUES, PROCESSES FOR THEIR PREPARATION AND THEIR USE IN MEDICINE BEECHAM GROUP PLC (GB) 1987-03-04 EP disclosed
EP-0195097-A1 Arachidonic acid analogues, processes for their preparation and their use in medicine BEECHAM GROUP PLC (GB) 1986-09-24 EP disclosed
EP-0142145-A2 Arachidonic acid analogues, processes for their preparation and their use in medicine BEECHAM GROUP PLC (GB) 1985-05-22 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-20050124656-A1 Substituted methylene amide derivatives as modulators of protein tyrosine phosphatases(ptps) PTPRS, PTPA, PTPMT1 FFAR1 619/4885FFAR4 968/4885MMP2 2960/4885

“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.