SCHEMBL22025368

SCHEMBL22025368

Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1Nc1nc(-c2ccncc2)nc2[nH]cnc12

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KIT P10721 9/20 0.68
CSF1R P07333 8/20 0.68
BRAF P15056 4/20 0.63
ABL1 P00519 7/20 0.63
LYN P07948 2/20 0.63
BCR P11274 2/20 0.63
EGFR P00533 3/20 0.60

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
SCHEMBL22024721 0.97 BRAF (0.68) KITCSF1RBRAFABL1LYN
SCHEMBL22025362 0.92 ABL1 (0.72) KITCSF1RBRAFABL1LYN
SCHEMBL22025314 0.90 ABL1 (0.72) KITCSF1RBRAFABL1LYN
SCHEMBL21942937 0.87 RET (0.67) KITCSF1RBRAFABL1LYN
SCHEMBL22024712 0.86 BRAF (0.68) KITCSF1RBRAFABL1EGFR
SCHEMBL22024729 0.85 BRAF (0.68) KITCSF1RBRAFABL1LYN
SCHEMBL22024732 0.84 BRAF (0.68) KITCSF1RBRAFABL1EGFR
SCHEMBL22025548 0.82 BRAF (0.68) KITCSF1RBRAFABL1LYN
SCHEMBL22025311 0.82 BRAF (0.68) KITCSF1RBRAFABL1LYN
SCHEMBL3561586 0.81 KIT (0.71) KITCSF1RBRAFABL1LYN

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-11352354-B2 Substituted penta-fused hexa-heterocyclic compounds, preparation method therefor, drug combination and use thereof XIAMEN UNIVERSITY (CN) 2022-06-07 US disclosed
US-20200165246-A1 SUBSTITUTED PENTA-FUSED HEXA-HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, DRUG COMBINATION AND USE THEREOF XIAMEN UNIVERSITY (CN) 2020-05-28 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-11352354-B2 Substituted penta-fused hexa-heterocyclic compounds, preparation method therefor, drug combination and use thereof PIKFYVE, PIK3CA, PIK3C2A KIT 495/4885CSF1R 3197/4885BRAF 65/4885
US-20200165246-A1 SUBSTITUTED PENTA-FUSED HEXA-HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, DRUG COMBINATION AND USE THEREOF PIKFYVE, PIK3CA, PIK3C2A KIT 495/4885CSF1R 3197/4885BRAF 65/4885

“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.