SCHEMBL22024658

SCHEMBL22024658

Cc1ccc(C(=O)Nc2cccc(OC(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)c2[nH]ccc2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIKFYVE Q9Y2I7 11/20 1.00
ABL1 P00519 4/20 0.53
BRAF P15056 4/20 0.48
PDGFRB P09619 2/20 0.47
PDGFRA P16234 2/20 0.47
LCK P06239 1/20 0.47
LYN P07948 1/20 0.47
KIT P10721 1/20 0.47
FLT3 P36888 1/20 0.47
DDR2 Q16832 1/20 0.47
BCR P11274 1/20 0.47

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
SCHEMBL22025345 0.92 PIKFYVE (0.85) PIKFYVEBRAF
SCHEMBL22024612 0.90 PIKFYVE (0.81) PIKFYVEBRAFKIT
SCHEMBL22024657 0.89 PIKFYVE (0.89) PIKFYVEABL1BRAFPDGFRBLCK
SCHEMBL22065386 0.88 PIKFYVE (0.79) PIKFYVEBRAF
SCHEMBL22025081 0.88 PIKFYVE (0.79) PIKFYVEBRAFDDR2
SCHEMBL22024660 0.88 PIKFYVE (0.79) PIKFYVEBRAF
SCHEMBL22024661 0.88 PIKFYVE (0.79) PIKFYVEBRAF
SCHEMBL22025046 0.88 PIKFYVE (0.78) PIKFYVEABL1BRAFPDGFRBLCK
SCHEMBL22025483 0.86 PIKFYVE (1.00) PIKFYVEABL1BRAFPDGFRBPDGFRA
SCHEMBL22024626 0.85 PIKFYVE (1.00) PIKFYVEABL1PDGFRBPDGFRAKIT

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 PIKFYVE 1/4885ABL1 1429/4885BRAF 65/4885
US-20200165246-A1 SUBSTITUTED PENTA-FUSED HEXA-HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, DRUG COMBINATION AND USE THEREOF PIKFYVE, PIK3CA, PIK3C2A PIKFYVE 1/4885ABL1 1429/4885BRAF 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.