SCHEMBL8910901

SCHEMBL8910901

CCOC(=O)c1c(-c2ccccc2)nc2cc(C)ccn12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 1.00
RAB9A P51151 2/20 1.00
CYP1A2 P05177 3/20 0.76
CYP2C9 P11712 3/20 0.76
CYP2C19 P33261 3/20 0.76
SMN1; SMN2 Q16637 1/20 0.76
CGAS Q8N884 1/20 0.70
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2D6 P10635 1/20 0.62
ALDH1A1 P00352 2/20 0.59
MAPK1 P28482 2/20 0.54
MAPT P10636 2/20 0.53
KDM4E B2RXH2 1/20 0.52
NTRK1 P04629 1/20 0.52
AKT1 P31749 1/20 0.52
AKT2 P31751 1/20 0.52
PKM P14618 1/20 0.49
PKLR P30613 1/20 0.49

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
SCHEMBL20579849 0.90 RAB9A (0.82) NPC1RAB9ACYP1A2CYP2C9CYP2C19
SCHEMBL20579811 0.89 NPC1 (0.80) NPC1RAB9ACYP1A2CYP2C9CYP2C19
SCHEMBL20579750 0.89 NPC1 (0.79) NPC1RAB9ACYP1A2CYP2C9CYP2C19
SCHEMBL20579803 0.88 RAB9A (0.79) NPC1RAB9ACYP1A2CYP2C9CYP2C19
SCHEMBL20579780 0.88 NPC1 (0.78) NPC1RAB9ACYP1A2CYP2C9CYP2C19
SCHEMBL20579805 0.87 NPC1 (0.77) NPC1RAB9ACYP1A2CYP2C9CYP2C19
SCHEMBL8912069 0.86 RAB9A (0.76) NPC1RAB9ACYP1A2CYP2C9CYP2C19
SCHEMBL10675936 0.86 CYP1A2 (1.00) NPC1RAB9ACYP1A2CYP2C9CYP2C19
SCHEMBL7833938 0.84 CGAS (0.76) NPC1RAB9ACYP1A2CYP2C9CYP2C19
SCHEMBL20579808 0.84 NPC1 (0.72) NPC1RAB9ACYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10323033-B2 Imidazo[1,2-A]pyridine-3-carboxylate derivative and preparation method thereof KNU-INDUSTRY COOPERATION FOUNDATION (KR) 2019-06-18 US disclosed
US-10323033-B2 Imidazo[1,2-A]pyridine-3-carboxylate derivative and preparation method thereof KNU-INDUSTRY COOPERATION FOUNDATION (KR) 2019-06-18 US disclosed
US-20180354948-A1 IMIDAZO[1,2-A]PYRIDINE-3-CARBOXYLATE DERIVATIVE AND PREPARATION METHOD THEREOF KNU-INDUSTRY COOPERATION FOUNDATION (KR) 2018-12-13 US disclosed
US-5635525-A DIAGNOSTICS HOECHST AKTIENGESELLSCHAFT (DE) 1997-06-03 US disclosed
US-5444068-A Imidazopyridine derivatives as angiotensin II receptor antagonists, pharmaceuticals, and treatment of hypertension therewith HOECHST AKTIENGESELLSCHAFT (DE) 1995-08-22 US disclosed
EP-0450566-B1 Substituted azoles, method for their preparation, these containing compositions and their use HOECHST AG (DE) 1995-07-05 EP disclosed
EP-0450566-A1 Substituted azoles, method for their preparation, these containing compositions and their use HOECHST AKTIENGESELLSCHAFT (DE) 1991-10-09 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 (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-20180354948-A1 IMIDAZO[1,2-A]PYRIDINE-3-CARBOXYLATE DERIVATIVE AND PREPARATION METHOD THEREOF AZI2, AOC3, AOC2 NPC1 4717/4885RAB9A 3999/4885CYP1A2 10/4885
US-10323033-B2 Imidazo[1,2-A]pyridine-3-carboxylate derivative and preparation method thereof AZI2, AOC3, AOC2 NPC1 4717/4885RAB9A 3999/4885CYP1A2 10/4885

“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.