SCHEMBL8304201

SCHEMBL8304201

CCc1ncnc(NC(CO)Cc2ccc(C(C)(C)C)cc2)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR9 P51686 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ RECQL P46063 1/20 0.33
▸ TP53 P04637 2/20 0.32
▸ TSHR P16473 1/20 0.32
▸ RPS6KB1 P23443 2/20 0.32
▸ AURKA O14965 1/20 0.32
▸ CHRM4 P08173 2/20 0.32
▸ RET P07949 1/20 0.31
▸ FYN P06241 1/20 0.31
▸ ROCK2 O75116 1/20 0.31
▸ PRKACA P17612 1/20 0.31
▸ IRAK1 P51617 1/20 0.31
▸ PRKX P51817 1/20 0.31
▸ LIMK1 P53667 1/20 0.31
▸ PRKG2 Q13237 1/20 0.31

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
SCHEMBL8304442 0.81 EGFR (0.41) CCR9RPS6KB1AURKA
SCHEMBL7992661 0.81 KDM4E (0.41) KDM4ENPC1HPGDRAB9ASMN1; SMN2
SCHEMBL9085869 0.75 GALR3 (0.45) RAB9ASMN1; SMN2TP53TSHRAURKA
SCHEMBL9528635 0.73 EGFR (0.40) RPS6KB1AURKA
SCHEMBL28943346 0.72 AURKA (0.40) KDM4ENPC1HPGDRAB9ASMN1; SMN2
SCHEMBL28943348 0.72 AURKA (0.40) KDM4ENPC1HPGDRAB9ASMN1; SMN2
SCHEMBL9403796 0.69 EGFR (0.55) RPS6KB1AURKA
SCHEMBL9192875 0.68 KDM4E (0.35) KDM4ENPC1HPGDRAB9ASMN1; SMN2
SCHEMBL8095407 0.64 CRHR1 (0.37) KDM4ENPC1HPGDRAB9ASMN1; SMN2
SCHEMBL17133553 0.64 PDE2A (0.47) RAB9ASMN1; SMN2TSHRAURKAAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0555388-B1 INSECTICIDAL, ACARICIDAL AND FUNGICIDAL AMINOPYRIMIDINES DU PONT (US) 1999-01-27 — — EP claimed
US-5378708-A Agricultural pesticides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-01-03 — — US claimed
EP-0555388-A1 INSECTICIDAL, ACARICIDAL AND FUNGICIDAL AMINOPYRIMIDINES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-08-18 — — EP claimed
WO-1992008704-A1 INSECTICIDAL, ACARICIDAL AND FUNGICIDAL AMINOPYRIMIDINES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-05-29 — — WO claimed
EP-0684242-B1 ISOXAZOLIDINEDIONE DERIVATIVE AND USE THEREOF JAPAN TOBACCO INC (JP) 1999-05-06 — — EP disclosed
EP-0555388-B1 INSECTICIDAL, ACARICIDAL AND FUNGICIDAL AMINOPYRIMIDINES DU PONT (US) 1999-01-27 — — EP disclosed
EP-0555388-A1 INSECTICIDAL, ACARICIDAL AND FUNGICIDAL AMINOPYRIMIDINES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-08-18 — — EP disclosed
WO-1992008704-A1 INSECTICIDAL, ACARICIDAL AND FUNGICIDAL AMINOPYRIMIDINES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-05-29 — — WO disclosed
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