SCHEMBL967912

SCHEMBL967912

c1cnn(-c2nncs2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
KDM4E B2RXH2 4/20 0.38
GAA P10253 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
G6PD P11413 1/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 2/20 0.38
NOTUM Q6P988 1/20 0.37
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ADORA2A P29274 4/20 0.35
ADORA3 P0DMS8 1/20 0.35
ADORA2B P29275 1/20 0.35
ADORA1 P30542 1/20 0.35
MAPK1 P28482 2/20 0.34
TDO2 P48775 1/20 0.33
HTT P42858 2/20 0.32

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
SCHEMBL1782525 0.69 ALDH1A1 (0.45) ALDH1A1KDM4EGAAKMT2ALMNA
SCHEMBL7905948 0.68 KDM4E (0.35) ALDH1A1KDM4EGAAKMT2AHPGD
SCHEMBL31201062 0.67 ALDH1A1 (0.42) ALDH1A1KDM4EGAAKMT2ALMNA
SCHEMBL17895476 0.67 ALDH1A1 (0.42) ALDH1A1KDM4EGAAKMT2ALMNA
SCHEMBL17476686 0.66 KDM4E (0.48) ALDH1A1KDM4EGAAKMT2ALMNA
SCHEMBL6558303 0.66 ALDH1A1 (0.53) ALDH1A1KDM4EGAAKMT2ALMNA
SCHEMBL12402334 0.65 ALDH1A1 (0.57) ALDH1A1KDM4EGAAKMT2ALMNA
SCHEMBL10136903 0.65 ALDH1A1 (0.57) ALDH1A1KDM4EGAAKMT2ALMNA
SCHEMBL12402363 0.63 ALDH1A1 (0.41) ALDH1A1KDM4EGAAKMT2ALMNA
SCHEMBL21721831 0.62 ALDH1A1 (0.53) ALDH1A1KDM4EGAAKMT2ALMNA

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
US-7871982-B2 Lincomycin derivatives and antimicrobial agents comprising the same as active ingredient MEIJI SEIKA KAISHA, LTD. (JP) 2011-01-18 US claimed
US-20090156512-A1 potent activity against resistant pneumococci MEIJI SEIKA KAISHA, LTD. (JP) 2009-06-18 US claimed
EP-1970377-A1 LINCOMYCIN DERIVATIVE AND ANTIBACTERIAL AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD. (JP) 2008-09-17 EP claimed
US-20240270740-A1 INHIBITORS OF CYCLIC GMP-AMP SYNTHASE AND USES THEREOF VENTUS THERAPEUTICS U.S., INC. 2024-08-15 US disclosed
EP-2902026-A1 THIAZOLIDINEDIONE ANALOGUES FOR THE TREATMENT OF METABOLIC INFLAMMATION MEDIATED DISEASE Metabolic Solutions Development Company LLC (US) 2015-08-05 EP disclosed
EP-2486926-A1 Thiazolidinedione Analogues Metabolic Solutions Development Company LLC (US) 2012-08-15 EP disclosed
US-7871982-B2 Lincomycin derivatives and antimicrobial agents comprising the same as active ingredient MEIJI SEIKA KAISHA, LTD. (JP) 2011-01-18 US disclosed
US-20090156512-A1 potent activity against resistant pneumococci MEIJI SEIKA KAISHA, LTD. (JP) 2009-06-18 US disclosed
EP-2001468-A2 THIAZOLIDINEDIONE ANALOGUES Metabolic Solutions Development Company (US) 2008-12-17 EP disclosed
EP-1970377-A1 LINCOMYCIN DERIVATIVE AND ANTIBACTERIAL AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD. (JP) 2008-09-17 EP disclosed
WO-2007109024-A2 THIAZOLIDINEDIONE ANALOGUES FOR THE TREATMENT OF METABOLIC INFLAMMATION MEDIATED DISEASE METABOLIC SOLUTIONS DEVELOPMENT COMPANY (US) 2007-09-27 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-20240270740-A1 INHIBITORS OF CYCLIC GMP-AMP SYNTHASE AND USES THEREOF CGAS, GMPS, PRKG1 ALDH1A1 1281/4885KDM4E 3763/4885GAA 59/4885
US-20090156512-A1 potent activity against resistant pneumococci H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, NAT1, NPM1 ALDH1A1 2976/4885KDM4E 3077/4885GAA 3927/4885

“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.