SCHEMBL12294711

SCHEMBL12294711

Cc1cc(C(=O)NC(C)(C)CO)ccn1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.50
▸ RAB9A P51151 3/20 0.50
▸ ATM Q13315 1/20 0.50
▸ MAPK1 P28482 1/20 0.45
▸ MAP4K4 O95819 2/20 0.44
▸ CNR2 P34972 6/20 0.43
▸ CNR1 P21554 5/20 0.43
▸ LMNA P02545 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ SYK P43405 1/20 0.42
▸ ABL1 P00519 1/20 0.41
▸ DGAT2 Q96PD7 2/20 0.41
▸ ANO1 Q5XXA6 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40

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
SCHEMBL9382063 0.84 LMNA (0.47) NPC1RAB9AMAPK1LMNASMN1; SMN2
SCHEMBL9307990 0.79 KDM4E (0.53) NPC1RAB9AATMCNR2CNR1
SCHEMBL2759010 0.77 NPC1 (0.61) NPC1RAB9AATMMAP4K4CNR2
SCHEMBL30637340 0.77 KDM4E (0.55) NPC1RAB9ALMNASMN1; SMN2
SCHEMBL1543956 0.77 KDM4E (0.55) NPC1RAB9ALMNASMN1; SMN2
SCHEMBL21212121 0.76 LMNA (0.46) NPC1RAB9ACNR2LMNASMN1; SMN2
SCHEMBL14082378 0.75 KDM1A (0.47) NPC1RAB9AATMMAP4K4CNR2
SCHEMBL28697954 0.75 HDAC6 (0.60) —
SCHEMBL8566224 0.75 PLK1 (0.50) NPC1RAB9ALMNASMN1; SMN2HTT
SCHEMBL10357586 0.75 HPGD (0.51) MAPK1CNR1HTT

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-20130096104-A1 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE GENENTECH, INC. (US) 2013-04-18 — — US disclosed
WO-2011113802-A2 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2011-09-22 — — 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 (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-20130096104-A1 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE TYK2, IRAK1, IRAK4 NPC1 4716/4885RAB9A 3219/4885ATM 1510/4885

“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.

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