SCHEMBL5472015

SCHEMBL5472015

Cc1cc(N)c(C(=O)O)c(C)c1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.45
ACHE P22303 1/20 0.45
KMT2A Q03164 5/20 0.44
KDM4E B2RXH2 4/20 0.44
TDP1 Q9NUW8 3/20 0.44
MEN1 O00255 3/20 0.44
MAPK1 P28482 3/20 0.42
ALDH1A1 P00352 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
LDHA P00338 3/20 0.41
LDHB P07195 3/20 0.41
MAPT P10636 3/20 0.39
NOTUM Q6P988 1/20 0.38
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37

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
SCHEMBL29918082 0.87 KDM4E (0.44) CYP3A4ACHEKMT2AKDM4ETDP1
SCHEMBL8106142 0.84 CYP3A4 (0.54) CYP3A4ACHEKMT2AKDM4ETDP1
SCHEMBL7016016 0.83 KMT2A (0.41) CYP3A4KMT2AKDM4ETDP1MEN1
SCHEMBL27451659 0.83 CYP3A4 (0.45) CYP3A4ACHEKMT2AKDM4ETDP1
SCHEMBL844533 0.82 CYP3A4 (0.49) CYP3A4KMT2ATDP1MEN1MAPK1
SCHEMBL29918124 0.82 ALDH1A1 (0.44) CYP3A4ACHEKMT2AKDM4ETDP1
Hydrochloric Acid SCHEMBL5042476 0.81 CYP3A4 (0.52) CYP3A4ACHEKMT2AKDM4ETDP1
Hydrochloric Acid SCHEMBL5037307 0.81 CYP3A4 (0.52) CYP3A4ACHEKMT2AKDM4ETDP1
SCHEMBL11204746 0.81 ALDH1A1 (0.45) CYP3A4ACHEKMT2AKDM4ETDP1
SCHEMBL15957633 0.81 KDM4E (0.47) CYP3A4ACHEKMT2AKDM4ETDP1

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-8552015-B2 Quinazolinone derivatives and their use as CB agonists NOVARTIS AG (CH) 2013-10-08 US disclosed
US-20070265285-A1 Quinazolinone derivatives and their use as CB agonists NOVARTIS AG (CH) 2007-11-15 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-20070265285-A1 Quinazolinone derivatives and their use as CB agonists CNR1, ADRB1, ADRA1D CYP3A4 91/4885ACHE 838/4885KMT2A 4569/4885

“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.