SCHEMBL4327641

SCHEMBL4327641

O=C(NCc1ccc(C(F)(F)F)cn1)c1nc(-c2cccnc2)n2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 1/20 0.43
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
PPARG P37231 1/20 0.40
NR2E3 Q9Y5X4 1/20 0.40
NCOR2 Q9Y618 1/20 0.40
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
PKM P14618 1/20 0.39
TACR1 P25103 2/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
METTL3 Q86U44 1/20 0.39
SORT1 Q99523 2/20 0.38

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
SCHEMBL4323392 0.89 GLS (0.43) IDH1KMT2AMEN1PPARGNR2E3
SCHEMBL4325871 0.86 RAB9A (0.46) KMT2AMEN1MAPTLMNASMN1; SMN2
SCHEMBL4327243 0.81 ALDH1A1 (0.55) KMT2ALMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL4319159 0.79 ADORA2A (0.45) KMT2ALMNAKDM4EALDH1A1GAA
SCHEMBL4332986 0.78 RAB9A (0.47) KMT2AMEN1MAPTLMNASMN1; SMN2
SCHEMBL4331382 0.77 ADORA2A (0.46) KMT2AKDM4EALDH1A1GAA
Trifluoroacetic Acid SCHEMBL4333538 0.73 ATR (0.52) KMT2APPARGNR2E3NCOR2LMNA
SCHEMBL4318734 0.73 CNR2 (0.49) SMN1; SMN2ALDH1A1CNR2
SCHEMBL4327554 0.73 ATR (0.57) KMT2AMEN1
SCHEMBL4333122 0.73 CNR2 (0.60) SMN1; SMN2CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES MERCK & CO., INC. 2009-12-31 US disclosed
US-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES MERCK & CO., INC. 2009-12-31 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-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES CNR2, CNR1, TRPV1 IDH1 2182/4885KMT2A 1982/4885MEN1 4456/4885

“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.