SCHEMBL30692634

SCHEMBL30692634

CN1CCN(C2CCN(c3ccc4cc(Nc5ncc(Cl)c(Nc6cc(Cl)c(Cl)cc6NS(C)(=O)=O)n5)ccc4n3)CC2)CC1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 16/20 0.58
▸ ALK Q9UM73 4/20 0.51
▸ ROS1 P08922 2/20 0.51
▸ INSR P06213 1/20 0.51
▸ IGF1R P08069 1/20 0.51
▸ FLT3 P36888 1/20 0.51

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
SCHEMBL26906712 1.00 EGFR (0.58) EGFRALKROS1INSRIGF1R
SCHEMBL29904655 0.91 EGFR (0.52) EGFRALKROS1INSRIGF1R
SCHEMBL26906835 0.91 EGFR (0.52) EGFRALKROS1INSRIGF1R
SCHEMBL26906955 0.85 EGFR (0.61) EGFRALKINSRIGF1R
SCHEMBL29904670 0.84 EGFR (0.51) EGFRALKROS1FLT3
SCHEMBL26906518 0.84 EGFR (0.51) EGFRALKROS1FLT3
SCHEMBL26906770 0.83 EGFR (0.49) EGFR
SCHEMBL29904622 0.82 EGFR (0.70) EGFRALKROS1INSRIGF1R
SCHEMBL29114866 0.82 EGFR (0.70) EGFRALKROS1INSRIGF1R
SCHEMBL26906573 0.79 EGFR (0.61) EGFRALKINSRIGF1R

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
EP-4286376-A1 PYRIMIDINE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND THERAPEUTIC PHARMACEUTICAL COMPOSITION COMPRISING SAME Therapex Co., Ltd. (KR) 2023-12-06 — — EP claimed
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