SCHEMBL16228010

SCHEMBL16228010

Cc1ccc2ccc(C(N)=O)nc2c1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.57
KDM4E B2RXH2 4/20 0.49
RAB9A P51151 2/20 0.49
MAPT P10636 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
PARP1 P09874 2/20 0.40
KMT2A Q03164 1/20 0.39
LCK P06239 1/20 0.38
CCNC P24863 1/20 0.38
CDK8 P49336 1/20 0.38
NPC1 O15118 1/20 0.38
MITF O75030 1/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38
AGTR1 P30556 1/20 0.38
HTT P42858 1/20 0.38
NNMT P40261 1/20 0.37
PKMYT1 Q99640 5/20 0.36

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
SCHEMBL16232861 0.84 KDM4E (0.50) PIM1KDM4ERAB9AMAPTTDP1
SCHEMBL935079 0.84 PIM1 (0.54) PIM1KDM4ERAB9AMAPTTDP1
SCHEMBL16228213 0.84 KDM4E (0.68) PIM1KDM4ERAB9AMAPTTDP1
SCHEMBL14610232 0.80 PIM1 (0.68) PIM1KDM4EPARP1KMT2ALCK
SCHEMBL16228012 0.79 KDM4E (0.46) PIM1KDM4ERAB9AMAPTTDP1
SCHEMBL21441804 0.78 PARP1 (0.59) PIM1KDM4ERAB9AMAPTPARP1
SCHEMBL3956008 0.77 PIM1 (0.57) PIM1ALDH1A1
SCHEMBL16228335 0.76 OPRK1 (0.59) PIM1KDM4ERAB9AMAPTTDP1
SCHEMBL3999989 0.75 NOS3 (0.46) PIM1KDM4ETDP1KMT2ALMNA
SCHEMBL3956011 0.73 PIM1 (0.51) PIM1KDM4ERAB9AMAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140336221-A1 Antibiotic and Anti-Parasitic Agents that Modulate Class II Fructose 1, 6-Bisphosphate Aldolase COLORADO SEMINARY, WHICH OWNS AND OPERATES THE UNIVERSITY OF DENVER (US) 2014-11-13 US claimed
US-9394254-B2 Antibiotic and anti-parasitic agents that modulate class II fructose 1,6-bisphosphate aldolase The University of Denver and Regis University (US) 2016-07-19 US disclosed
US-9394254-B2 Antibiotic and anti-parasitic agents that modulate class II fructose 1,6-bisphosphate aldolase The University of Denver and Regis University (US) 2016-07-19 US disclosed
US-9394254-B2 Antibiotic and anti-parasitic agents that modulate class II fructose 1,6-bisphosphate aldolase The University of Denver and Regis University (US) 2016-07-19 US disclosed
EP-2994142-A1 ANTIBIOTIC AND ANTI-PARASITIC AGENTS THAT MODULATE CLASS II FRUCTOSE 1,6-BISPHOSPHATE ALDOLASE Colorado Seminary, Which Owns and Operates The University of Denver (US) 2016-03-16 EP disclosed
US-20140336221-A1 Antibiotic and Anti-Parasitic Agents that Modulate Class II Fructose 1, 6-Bisphosphate Aldolase COLORADO SEMINARY, WHICH OWNS AND OPERATES THE UNIVERSITY OF DENVER (US) 2014-11-13 US disclosed
US-20140336221-A1 Antibiotic and Anti-Parasitic Agents that Modulate Class II Fructose 1, 6-Bisphosphate Aldolase COLORADO SEMINARY, WHICH OWNS AND OPERATES THE UNIVERSITY OF DENVER (US) 2014-11-13 US disclosed
US-20140336221-A1 Antibiotic and Anti-Parasitic Agents that Modulate Class II Fructose 1, 6-Bisphosphate Aldolase COLORADO SEMINARY, WHICH OWNS AND OPERATES THE UNIVERSITY OF DENVER (US) 2014-11-13 US 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-20140336221-A1 Antibiotic and Anti-Parasitic Agents that Modulate Class II Fructose 1, 6-Bisphosphate Aldolase ALDOA, DERA, FBP1 PIM1 3196/4885KDM4E 718/4885RAB9A 2894/4885

“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.