SCHEMBL22025548

SCHEMBL22025548

Cc1ccc(C(=O)Nc2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1Nc1nc(-c2ccncc2)nc2ccn(C)c12

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRAF P15056 8/20 0.68
ABL1 P00519 7/20 0.64
CSF1R P07333 4/20 0.63
KIT P10721 4/20 0.63
EGFR P00533 6/20 0.62
LYN P07948 2/20 0.58
BCR P11274 2/20 0.58
POLB P06746 1/20 0.58
MAPT P10636 1/20 0.58
MAPK1 P28482 1/20 0.58
RAD52 P43351 1/20 0.58
ATM Q13315 1/20 0.58

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
SCHEMBL22024747 0.92 ABL1 (0.71) BRAFABL1CSF1RKITEGFR
SCHEMBL22025311 0.89 BRAF (0.68) BRAFABL1CSF1RKITEGFR
SCHEMBL21942987 0.89 RET (0.65) BRAFABL1CSF1RKITEGFR
SCHEMBL22024732 0.87 BRAF (0.68) BRAFABL1CSF1RKITEGFR
SCHEMBL21942982 0.87 KIT (0.62) BRAFABL1CSF1RKITEGFR
SCHEMBL21974796 0.87 BRAF (0.63) BRAFABL1CSF1RKITEGFR
SCHEMBL22024729 0.86 BRAF (0.68) BRAFABL1CSF1RKITEGFR
SCHEMBL22024712 0.85 BRAF (0.68) BRAFABL1CSF1RKITEGFR
SCHEMBL22024721 0.85 BRAF (0.68) BRAFABL1CSF1RKITEGFR
SCHEMBL22024635 0.83 BRAF (0.69) BRAFABL1CSF1RKITEGFR

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 3 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
EP-3663293-A1 SUBSTITUTED PENTA- AND HEXA-HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, DRUG COMBINATION AND USE THEREOF Xiamen University (CN) 2020-06-10 EP 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 BRAF 65/4885ABL1 1429/4885CSF1R 3197/4885
US-20200165246-A1 SUBSTITUTED PENTA-FUSED HEXA-HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, DRUG COMBINATION AND USE THEREOF PIKFYVE, PIK3CA, PIK3C2A BRAF 65/4885ABL1 1429/4885CSF1R 3197/4885

“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.