SCHEMBL6328402

SCHEMBL6328402

Clc1cccc(Cl)c1Nc1ncc(-c2ccccc2)s1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDR P35968 17/20 0.68
CNR1 P21554 1/20 0.51
LIMK1 P53667 1/20 0.49
ABL1 P00519 1/20 0.49
LCK P06239 1/20 0.49
CSF1R P07333 1/20 0.49
PDGFRB P09619 1/20 0.49
MAP2K2 P36507 1/20 0.49
CDK7 P50613 1/20 0.49

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
SCHEMBL6328597 0.87 KDR (0.64) KDR
SCHEMBL7228893 0.82 KDR (0.63) KDRCNR1
SCHEMBL7237283 0.81 KDR (1.00) KDRCNR1ABL1LCKCSF1R
SCHEMBL3651635 0.81 KDR (1.00) KDR
SCHEMBL6332623 0.81 KDR (0.79) KDRCNR1LIMK1
SCHEMBL6330201 0.80 KDR (0.68) KDRCNR1LIMK1
SCHEMBL6330223 0.80 KDR (0.71) KDRCNR1
SCHEMBL6336657 0.79 KDR (0.63) KDRCNR1
SCHEMBL6336582 0.79 KDR (0.63) KDRCNR1
SCHEMBL6335500 0.78 KDR (0.74) KDRCNR1LIMK1

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-20050228031-A1 Tyrosine kinase inhibitors BILODEAU MARK T 2005-10-13 US claimed
US-20050228031-A1 Tyrosine kinase inhibitors BILODEAU MARK T 2005-10-13 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-20050228031-A1 Tyrosine kinase inhibitors ERBB2, TYRO3, TIE1 KDR 5/4885CNR1 3794/4885LIMK1 189/4885

“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.