SCHEMBL14007366

SCHEMBL14007366

CCc1ccc2ccc(C(=O)O)c(O)c2n1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 18/20 0.58
ALDH1A1 P00352 1/20 0.53
PARP1 P09874 1/20 0.53

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
SCHEMBL20845592 0.80 PARP1 (0.74) PIM1ALDH1A1PARP1
SCHEMBL7330187 0.79 GABRP (0.47) PIM1ALDH1A1PARP1
SCHEMBL27926381 0.79 PARP1 (0.72) PIM1ALDH1A1PARP1
SCHEMBL8668423 0.78 PARP1 (0.41) PIM1ALDH1A1PARP1
SCHEMBL10721784 0.78 KDM4A (0.60) PIM1PARP1
SCHEMBL31654039 0.77 ALDH1A1 (0.57) PIM1ALDH1A1PARP1
SCHEMBL3225103 0.77 ALDH1A1 (0.57) PIM1ALDH1A1PARP1
SCHEMBL24834805 0.75 GABRP (0.47) ALDH1A1PARP1
SCHEMBL1997423 0.75 SMN1; SMN2 (0.57) ALDH1A1PARP1
SCHEMBL311735 0.75 GABRP (0.47) ALDH1A1PARP1

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-20080280849-A1 Synergic Combinations Comprising a Quinoline Compound and Other Hiv Infection Therapeutic Agents CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2008-11-13 US disclosed
US-20080161350-A1 USE OF QUINOLINE DERIVATIVES WITH ANTI-INTEGRASE EFFECT AND APPLICATIONS THEREOF BIOALLIANCE PHARMA SA 2008-07-03 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 (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-20080280849-A1 Synergic Combinations Comprising a Quinoline Compound and Other Hiv Infection Therapeutic Agents CTSL, CDKL1, QTRT2 PIM1 1303/4885ALDH1A1 2239/4885PARP1 60/4885
US-20080161350-A1 USE OF QUINOLINE DERIVATIVES WITH ANTI-INTEGRASE EFFECT AND APPLICATIONS THEREOF TYMP, CDK7, MAVS PIM1 171/4885ALDH1A1 853/4885PARP1 166/4885

“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.