SCHEMBL2989532

SCHEMBL2989532

CC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1CC(=O)c1ccc(N)cc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 6/20 0.50
BACE2 Q9Y5Z0 4/20 0.50
REN P00797 1/20 0.44
APP P05067 1/20 0.44
CTSD P07339 2/20 0.43
CTSE P14091 1/20 0.43
CYP19A1 P11511 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL2985753 0.90 BACE1 (0.46) BACE1BACE2RENAPPCTSD
SCHEMBL2980865 0.85 ALDH1A1 (0.46) BACE1BACE2CTSDCTSECYP3A4
SCHEMBL2977803 0.85 TP53 (0.45) BACE1BACE2CYP3A4CYP2C9CYP2C19
SCHEMBL2986525 0.83 CYP3A4 (0.38) BACE1BACE2CYP19A1CYP3A4CYP2C9
SCHEMBL2972544 0.82 BACE1 (0.44) BACE1BACE2RENAPPCTSD
SCHEMBL2985847 0.81 BACE1 (0.39) BACE1BACE2CTSDCTSECYP3A4
SCHEMBL2980706 0.80 ALDH1A1 (0.45) BACE1CTSDCYP2C19RAB9ASMN1; SMN2
SCHEMBL2986897 0.80 SMN1; SMN2 (0.50) BACE1BACE2CTSDCTSECYP3A4
SCHEMBL2984449 0.78 BACE1 (0.52) BACE1BACE2RENAPPCTSD
SCHEMBL2983179 0.77 NPC1 (0.49) MAPTRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7786155-B2 Organic compounds NOVARTIS AG (CH) 2010-08-31 US disclosed
EP-2212295-A2 4-PHENYL-5-OXO-IMIDAZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USES THEROF Novartis AG (CH) 2010-08-04 EP disclosed
WO-2009050201-A2 4-PHENYL-5-OXO-IMIDAZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USES THEROF NOVARTIS AG (CH) 2009-04-23 WO disclosed
US-20090099244-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-04-16 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-20090099244-A1 ORGANIC COMPOUNDS SLCO4C1, SLC10A6, SLCO1B1 BACE1 2113/4885BACE2 3063/4885REN 16/4885

“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.