SCHEMBL6481364

SCHEMBL6481364

Cc1cc(C)c2cc(Cl)ccc2n1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.72
ALDH1A1 P00352 1/20 0.62
NPFFR1 Q9GZQ6 1/20 0.57
NPFFR2 Q9Y5X5 1/20 0.57
CYP1A2 P05177 1/20 0.57
NR4A2 P43354 1/20 0.53
EGFR P00533 2/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
LMNA P02545 2/20 0.52
CRHR1 P34998 1/20 0.47
KDM4E B2RXH2 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C19 P33261 1/20 0.47
HIF1A Q16665 1/20 0.47
EHMT2 Q96KQ7 1/20 0.47
MPO P05164 1/20 0.45
HSP90AB1 P08238 1/20 0.45

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
SCHEMBL29589153 1.00 POLB (0.72) POLBALDH1A1NPFFR1NPFFR2CYP1A2
SCHEMBL3648083 0.84 LMNA (0.72) POLBALDH1A1NPFFR1NPFFR2CYP1A2
SCHEMBL2538783 0.84 KDM4E (0.66) POLBALDH1A1NPFFR1NPFFR2EGFR
SCHEMBL6492060 0.84 POLB (1.00) POLBALDH1A1CYP1A2NR4A2MEN1
SCHEMBL6481363 0.81 POLB (0.53) POLBALDH1A1NPFFR1NPFFR2CYP1A2
SCHEMBL4748554 0.81 POLB (0.53) POLBALDH1A1NPFFR1NPFFR2NR4A2
SCHEMBL440491 0.81 NR4A2 (0.74) POLBALDH1A1NR4A2MEN1KMT2A
SCHEMBL20867715 0.79 ALDH1A1 (0.57) POLBALDH1A1NPFFR1NPFFR2EGFR
SCHEMBL3531515 0.79 LMNA (0.66) POLBALDH1A1CYP1A2MEN1KMT2A
SCHEMBL26632753 0.78 POLB (0.50) POLBALDH1A1NPFFR1NPFFR2NR4A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114380741-B Preparation method of 4-position alkylated derivative of 2-methylquinoline compound 济南大学 2023-03-24 CN disclosed
CN-114380741-A Preparation method of 4-position alkylated derivative of 2-methylquinoline compound 济南大学 2022-04-22 CN disclosed
EP-2922845-B1 ANTHELMINTIC COMPOUNDS AND COMPOSITIONS AND METHOD OF USING THEREOF MERIAL INC (US) 2018-06-20 EP disclosed
US-9249102-B2 Anthelmintic compounds and compositions and method of using thereof MERIAL, INC. (US) 2016-02-02 US disclosed
US-9249102-B2 Anthelmintic compounds and compositions and method of using thereof MERIAL, INC. (US) 2016-02-02 US disclosed
US-20140142114-A1 ANTHELMINTIC COMPOUNDS AND COMPOSITIONS AND METHOD OF USING THEREOF MERIAL LIMITED (US) 2014-05-22 US disclosed
US-20140142114-A1 ANTHELMINTIC COMPOUNDS AND COMPOSITIONS AND METHOD OF USING THEREOF MERIAL LIMITED (US) 2014-05-22 US disclosed
US-6962938-B2 Spiro-cyclic β-amino acid derivatives as inhibitors of matrix metalloproteases and TNF-α converting enzyme (TACE) BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2005-11-08 US disclosed
US-6720329-B2 ANTIINFLAMMATORY AGENTS BRISTOL-MYERS SQUIBB PHARMA 2004-04-13 US disclosed
EP-1373199-A4 SPIRO-CYCLIC BETA-AMINO ACID DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES AND TNF-ALPHA CONVERTING ENZYME (TAGE) BRISTOL MYERS SQUIBB PHARMA CO (US) 2004-04-07 EP disclosed
EP-1373199-A2 SPIRO-CYCLIC BETA-AMINO ACID DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES AND TNF-ALPHA CONVERTING ENZYME (TAGE) Bristol-Myers Squibb Pharma Company (US) 2004-01-02 EP disclosed
WO-2002074738-A2 SPIRO-CYCLIC BETA-AMINO ACID DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES AND TNF-ALPHA CONVERTING ENZYME (TAGE) BRISTOL-MYERS SQUIBB COMPANY (US) 2002-09-26 WO 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-20140142114-A1 ANTHELMINTIC COMPOUNDS AND COMPOSITIONS AND METHOD OF USING THEREOF CYP3A5, ABCC5, CXXC5 POLB 4289/4885ALDH1A1 2176/4885NPFFR1 1869/4885

“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.