SCHEMBL12000236

SCHEMBL12000236

CCc1cc2cc(C)ccc2nc1Cl

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.58
▸ KMT2A Q03164 5/20 0.56
▸ NPSR1 Q6W5P4 3/20 0.56
▸ MEN1 O00255 3/20 0.48
▸ RXFP1 Q9HBX9 1/20 0.47
▸ GRM1 Q13255 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ POLB P06746 1/20 0.45
▸ PKM P14618 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ KDR P35968 1/20 0.43

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
SCHEMBL14617051 0.86 KMT2A (0.75) MAPTKMT2ANPSR1MEN1ALDH1A1
SCHEMBL19243071 0.86 KMT2A (0.75) MAPTKMT2ANPSR1MEN1RXFP1
SCHEMBL14617053 0.84 MAPT (0.57) MAPTKMT2ANPSR1MEN1ALDH1A1
SCHEMBL25587992 0.84 GRM1 (0.48) MAPTKMT2ANPSR1MEN1RXFP1
SCHEMBL13597686 0.81 MEN1 (0.54) MAPTKMT2AMEN1GRM1CYP1A2
SCHEMBL667729 0.81 GRM1 (0.46) MAPTKMT2ANPSR1MEN1RXFP1
SCHEMBL12749460 0.79 MAPT (0.71) MAPTKMT2ANPSR1MEN1RXFP1
SCHEMBL9379131 0.79 ALDH1A1 (0.53) MAPTKMT2ANPSR1MEN1ALDH1A1
SCHEMBL12000237 0.78 ALDH1A1 (0.59) MAPTKMT2ANPSR1MEN1RXFP1
SCHEMBL8352244 0.78 CYP1A2 (0.56) MAPTKMT2ANPSR1MEN1GRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8524738-B2 Quinolinones and quinoxalinones as antibacterial composition TOYAMA CHEMICAL CO., LTD. (JP) 2013-09-03 — — US disclosed
US-8524738-B2 Quinolinones and quinoxalinones as antibacterial composition TOYAMA CHEMICAL CO., LTD. (JP) 2013-09-03 — — US disclosed
US-8329694-B2 Quinoxalinones as antibacterial composition TOYAMA CHEMICAL CO., LTD. (JP) 2012-12-11 — — US disclosed
US-8329694-B2 Quinoxalinones as antibacterial composition TOYAMA CHEMICAL CO., LTD. (JP) 2012-12-11 — — US disclosed
US-20120214990-A1 QUINOLINONES AND QUINOXALINONES AS ANTIBACTERIAL COMPOSITION TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-08-23 — — US disclosed
US-20120214990-A1 QUINOLINONES AND QUINOXALINONES AS ANTIBACTERIAL COMPOSITION TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-08-23 — — US disclosed
US-20100168418-A1 NOVEL NITROGENATED HETEROCYCLIC COMPOUND AND SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2010-07-01 — — US disclosed
US-20100168418-A1 NOVEL NITROGENATED HETEROCYCLIC COMPOUND AND SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2010-07-01 — — 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-20100168418-A1 NOVEL NITROGENATED HETEROCYCLIC COMPOUND AND SALT THEREOF ROS1, NOX1, ARG1 MAPT 4858/4885KMT2A 1173/4885NPSR1 1224/4885
US-20120214990-A1 QUINOLINONES AND QUINOXALINONES AS ANTIBACTERIAL COMPOSITION NQO2, ASNS, NDUFS1 MAPT 3361/4885KMT2A 2354/4885NPSR1 3115/4885

“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.

Send feedback