SCHEMBL3561804

SCHEMBL3561804

Cc1ccc(NC(=O)c2ccc(CN3CCN(C(=O)OC(C)(C)C)CC3)c(C(F)(F)F)c2)cc1Nc1cc(-c2cccnc2)ccn1

nearest known ligand 0.77

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 10/20 0.77
KIT P10721 9/20 0.67
CSF1R P07333 7/20 0.67
BCR P11274 4/20 0.66
LYN P07948 3/20 0.66
EGFR P00533 2/20 0.57
BRAF P15056 2/20 0.57
PDGFRB P09619 1/20 0.56

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
SCHEMBL3561462 0.90 ABL1 (0.84) ABL1KITCSF1RBCRLYN
SCHEMBL3560630 0.90 ABL1 (0.94) ABL1KITCSF1RBCRLYN
Hydrochloric Acid SCHEMBL3565643 0.89 ABL1 (0.83) ABL1KITCSF1RBCRLYN
SCHEMBL3573834 0.88 ABL1 (0.81) ABL1KITCSF1RBCRLYN
SCHEMBL3571743 0.88 ABL1 (0.90) ABL1KITCSF1RBCRLYN
Hydrochloric Acid SCHEMBL3562726 0.88 ABL1 (0.80) ABL1KITCSF1RBCRLYN
SCHEMBL3567512 0.84 ABL1 (0.82) ABL1KITCSF1RBCRLYN
SCHEMBL3561439 0.83 ABL1 (0.94) ABL1KITCSF1RBCRLYN
SCHEMBL3569663 0.83 ABL1 (0.84) ABL1KITCSF1RBCRLYN
SCHEMBL3566300 0.83 ABL1 (0.81) ABL1KITCSF1RBCRLYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3299358-A1 AMIDE DERIVATIVE AND MEDICINE Nippon Shinyaku Co., Ltd. (JP) 2018-03-28 EP disclosed
EP-1702917-B1 AMIDE DERIVATIVE AND MEDICINE NIPPON SHINYAKU CO LTD (JP) 2017-08-02 EP disclosed
US-7728131-B2 3-difluoromethyl-4-(4-methylpiperazin-1-ylmethyl)-N-{4-methyl-3-[4-(5-pyrimidinyl)pyrimidin-2-ylamino]phenyl}benzamide, having excellent tyrosine kinase inhibitory activity, used as therapeutic agent for leukemia NIPPON SHINYAKU CO., LTD. (JP) 2010-06-01 US disclosed
US-20080293940-A1 Amide Derivative and Medicine NIPPON SHINYAKU CO., LTD. (JP) 2008-11-27 US disclosed
EP-1702917-A1 AMIDE DERIVATIVE AND MEDICINE Nippon Shinyaku Co., Ltd. (JP) 2006-09-20 EP 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-20080293940-A1 Amide Derivative and Medicine ABL2, ABL1, BCR ABL1 2/4885KIT 1217/4885CSF1R 865/4885

“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.