SCHEMBL24532018

SCHEMBL24532018

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2ccccc12

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 5/20 0.76
BRAF P15056 5/20 0.76
DDR1 Q08345 4/20 0.76
DDR2 Q16832 4/20 0.76
LCK P06239 4/20 0.76
ATM Q13315 3/20 0.76
SRC P12931 3/20 0.76
EPHB2 P29323 3/20 0.76
LMNA P02545 3/20 0.76
ABL1 P00519 3/20 0.76
BCR P11274 3/20 0.76
KDR P35968 3/20 0.76
ESYT2 A0FGR8 2/20 0.76
NBAS A2RRP1 2/20 0.76
CNOT1 A5YKK6 2/20 0.76
TBKBP1 A7MCY6 2/20 0.76
AGPS O00116 2/20 0.76
MYO1F O00160 2/20 0.76
SNAP23 O00161 2/20 0.76
AP3B1 O00203 2/20 0.76

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
SCHEMBL24532081 0.90 BRAF (0.80) MAPK14BRAFDDR1DDR2LCK
SCHEMBL17548873 0.88 DDR2 (0.76) MAPK14BRAFDDR1DDR2LCK
SCHEMBL22024839 0.88 MAPK14 (0.74) MAPK14BRAFDDR1DDR2LCK
SCHEMBL22025035 0.87 PIKFYVE (0.68) MAPK14BRAFDDR1DDR2LCK
SCHEMBL29358745 0.86 ABL1 (1.00) MAPK14BRAFDDR1DDR2LCK
SCHEMBL29380618 0.86 ABL1 (1.00) MAPK14BRAFDDR1DDR2LCK
SCHEMBL4699731 0.86 ABL1 (1.00) MAPK14BRAFDDR1DDR2LCK
SCHEMBL29931136 0.86 ABL1 (1.00) MAPK14BRAFDDR1DDR2LCK
SCHEMBL16111548 0.86 ABL1 (1.00) MAPK14BRAFDDR1DDR2LCK
SCHEMBL18804561 0.86 DDR1 (0.81) MAPK14BRAFDDR1DDR2LCK

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-20220194943-A1 RECEPTOR TYROSINE KINASE INHIBITORS FOR TREATMENT OF PROTEIN KINASE MODULATION-RESPONSIVE DISEASE OR DISORDER THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVIC (US) 2022-06-23 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-20220194943-A1 RECEPTOR TYROSINE KINASE INHIBITORS FOR TREATMENT OF PROTEIN KINASE MODULATION-RESPONSIVE DISEASE OR DISORDER EPHA1, EPHB2, EPHB1 MAPK14 185/4885BRAF 52/4885DDR1 285/4885

“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.