SCHEMBL28664529

SCHEMBL28664529

FC1(F)CCC(c2cc(Nc3ccnc(Cl)n3)n[nH]2)C1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 3/20 0.50
▸ NEK1 Q96PY6 1/20 0.48
▸ NTRK1 P04629 1/20 0.47
▸ PAK1 Q13153 5/20 0.47
▸ PAK3 O75914 1/20 0.47
▸ PAK2 Q13177 1/20 0.47
▸ PAK4 O96013 4/20 0.46
▸ CCNK O75909 1/20 0.44
▸ CDK13 Q14004 1/20 0.44
▸ CDK12 Q9NYV4 1/20 0.44

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
SCHEMBL24065156 1.00 IGF1R (0.50) IGF1RNEK1NTRK1PAK1PAK3
SCHEMBL14723359 0.91 PAK1 (0.54) IGF1RNEK1NTRK1PAK1PAK3
SCHEMBL1164508 0.84 IGF1R (0.65) IGF1RNEK1NTRK1PAK1PAK4
SCHEMBL24065121 0.84 IGF1R (0.51) IGF1RNEK1NTRK1PAK1PAK4
SCHEMBL14723558 0.82 PAK1 (0.52) IGF1RNEK1NTRK1PAK1PAK3
SCHEMBL14723204 0.82 IGF1R (0.60) IGF1RNEK1PAK1PAK4
SCHEMBL14723540 0.82 IGF1R (0.60) IGF1RNEK1PAK1PAK3PAK2
SCHEMBL24065066 0.78 PAK1 (0.50) IGF1RNEK1NTRK1PAK1PAK3
SCHEMBL24065100 0.77 IGF1R (0.52) IGF1RNEK1PAK1PAK4
SCHEMBL14723217 0.77 IGF1R (0.52) IGF1RNEK1PAK1PAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113710663-A Modulators of MYC family proto-oncogene proteins 纳罗医疗公司 2021-11-26 — — CN disclosed
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