SCHEMBL23917373

SCHEMBL23917373

Clc1ccccc1Nc1ccc2c(c1)C1C=CC=CC1=N2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.37
MAPK8 P45983 5/20 0.37
MAPK10 P53779 5/20 0.37
ACVRL1 P37023 1/20 0.36
TSHR P16473 1/20 0.33
IGF1R P08069 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NISCH Q9Y2I1 1/20 0.31
MAPK13 O15264 1/20 0.30
MAPK12 P53778 1/20 0.30
MAPK11 Q15759 1/20 0.30
AURKA O14965 1/20 0.30
AURKB Q96GD4 1/20 0.30
FADS1 O60427 1/20 0.30

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
SCHEMBL21622875 0.72 MAPK8 (0.41) MAPK14MAPK8MAPK10ACVRL1TSHR
SCHEMBL1670886 0.70 NOS1 (0.33)
SCHEMBL29383163 0.70 NOS1 (0.33)
SCHEMBL16914935 0.64 MAPK14 (0.36) MAPK14MAPK8MAPK10ACVRL1TSHR
SCHEMBL6354557 0.64 MAPK14 (0.49) MAPK14MAPK8MAPK10ACVRL1TSHR
SCHEMBL13232841 0.60 TSHR (0.46) MAPK14MAPK8MAPK10ACVRL1TSHR
SCHEMBL6355590 0.60 MAPK14 (0.47) MAPK14MAPK8MAPK10ACVRL1TSHR
SCHEMBL28976313 0.60 GSK3B (0.51) MAPK14MAPK8MAPK10ACVRL1TSHR
SCHEMBL11175497 0.60 GAA (0.49) MAPK14MAPK8MAPK10TSHRKMT2A
SCHEMBL30902223 0.59 TDP1 (0.61) MAPK14MAPK8MAPK10TSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210320264-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-10-14 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-20210320264-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES OR10J3, EPCAM, L1CAM MAPK14 3582/4885MAPK8 3589/4885MAPK10 2309/4885

“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.