SCHEMBL21632015

SCHEMBL21632015

COc1ccccc1C(C#N)CC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.55
POLB P06746 2/20 0.55
HTT P42858 2/20 0.55
NPSR1 Q6W5P4 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.46
KMT2A Q03164 3/20 0.44
LMNA P02545 2/20 0.44
CTSA P10619 2/20 0.43
KDM4E B2RXH2 2/20 0.42
PKM P14618 1/20 0.42
ALDH1A1 P00352 1/20 0.41
SGMS2 Q8NHU3 1/20 0.41
FFAR1 O14842 3/20 0.40

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
SCHEMBL21631933 0.88 L3MBTL1 (0.51) L3MBTL1POLBHTTNPSR1SMN1; SMN2
SCHEMBL21632162 0.86 POLB (0.50) L3MBTL1POLBHTTNPSR1SMN1; SMN2
SCHEMBL21632110 0.84 KMT2A (0.48) L3MBTL1POLBHTTNPSR1KMT2A
SCHEMBL21632117 0.82 FFAR1 (0.41) L3MBTL1POLBHTTNPSR1CTSA
SCHEMBL15248915 0.82 ALDH1A1 (0.44) L3MBTL1HTTSMN1; SMN2KMT2ALMNA
SCHEMBL21656298 0.81 HTT (0.46) L3MBTL1POLBHTTNPSR1SMN1; SMN2
SCHEMBL21632320 0.81 MEN1 (0.47) NPSR1KMT2ALMNACTSAALDH1A1
SCHEMBL433240 0.80 FFAR1 (0.52) SMN1; SMN2KMT2ALMNAALDH1A1SGMS2
SCHEMBL14881735 0.79 HPGD (0.40) FFAR1
SCHEMBL21632346 0.79 KMT2A (0.48) L3MBTL1POLBHTTNPSR1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11136296-B2 Substituted N-arylethyl-2-arylquinoline-4-carboxamides and use thereof BAYER AKTIENGESELLSCHAFT (DE) 2021-10-05 US disclosed
US-20200031775-A1 SUBSTITUTED N-ARYLETHYL-2-ARYLQUINOLINE-4-CARBOXAMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-01-30 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 (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-20200031775-A1 SUBSTITUTED N-ARYLETHYL-2-ARYLQUINOLINE-4-CARBOXAMIDES AND USE THEREOF AADAC, NAT1, EPX L3MBTL1 3686/4885POLB 3807/4885HTT 2899/4885
US-11136296-B2 Substituted N-arylethyl-2-arylquinoline-4-carboxamides and use thereof AADAC, NAT1, EPX L3MBTL1 3686/4885POLB 3807/4885HTT 2899/4885

“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.