SCHEMBL5189588

SCHEMBL5189588

c1ccc2c(c1)nnn2Nc1ccnnn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4Z1 Q86W10 10/20 0.43
CYP1A2 P05177 3/20 0.40
SLC9A1 P19634 3/20 0.40
POLB P06746 2/20 0.40
CYP2C9 P11712 2/20 0.40
MAPK1 P28482 1/20 0.40
ATM Q13315 1/20 0.40
KEAP1 Q14145 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPT P10636 1/20 0.40
THPO P40225 1/20 0.40
CYP2C8 P10632 1/20 0.38
CYP2B6 P20813 1/20 0.38
CYP4F8 P98187 1/20 0.38
CYP4F12 Q9HCS2 1/20 0.38
RAB9A P51151 1/20 0.37
DGAT1 O75907 1/20 0.37
CYP2C19 P33261 1/20 0.35

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
SCHEMBL8491002 0.73 CYP4Z1 (0.50) CYP4Z1CYP1A2SLC9A1POLBCYP2C9
SCHEMBL18833167 0.69 CYP4Z1 (0.53) CYP4Z1CYP1A2SLC9A1POLBCYP2C9
SCHEMBL29518725 0.69 CYP4Z1 (0.57) CYP4Z1CYP1A2SLC9A1POLBCYP2C9
SCHEMBL7243835 0.69 POLB (0.55) CYP4Z1CYP1A2SLC9A1POLBCYP2C9
SCHEMBL5662069 0.69 CYP4Z1 (0.57) CYP4Z1CYP1A2SLC9A1POLBCYP2C9
SCHEMBL16639135 0.69 CYP4Z1 (0.55) CYP4Z1CYP1A2SLC9A1POLBCYP2C9
SCHEMBL14548209 0.68 RAB9A (0.51) CYP4Z1CYP1A2SLC9A1POLBCYP2C9
SCHEMBL1757403 0.66 CYP4Z1 (0.50) CYP4Z1CYP1A2SLC9A1POLBMAPK1
SCHEMBL27416345 0.66 SLC9A1 (0.57) SLC9A1ALDH1A1CYP2D6MAPTRAB9A
SCHEMBL14679890 0.65 CYP4Z1 (0.71) CYP4Z1CYP1A2SLC9A1POLBCYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1727807-B1 ANTIOZONANT BASED FUNCTIONALIZED BENZOTRIAZOLE UV ABSORBERS AND THE PROCESS THEREOF COUNCIL SCIENT IND RES (IN) 2007-07-18 EP disclosed
US-7211675-B2 Antiozonant based on functionalized benzotriazole UV absorbers and the process thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2007-05-01 US disclosed
EP-1727807-A1 ANTIOZONANT BASED FUNCTIONALIZED BENZOTRIAZOLE UV ABSORBERS AND THE PROCESS THEREOF Council of Scientific and Industrial Research (IN) 2006-12-06 EP disclosed
WO-2005066141-A1 ANTIOZONANT BASED FUNCTIONALIZED BENZOTRIAZOLE UV ABSORBERS AND THE PROCESS THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2005-07-21 WO disclosed
US-20050143584-A1 Antiozonant based on functionalized benzotriazole UV absorbers and the process thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2005-06-30 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-20050143584-A1 Antiozonant based on functionalized benzotriazole UV absorbers and the process thereof SULT1A1, AOX1, XDH CYP4Z1 151/4885CYP1A2 29/4885SLC9A1 1655/4885

“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.