SCHEMBL7357775

SCHEMBL7357775

COC(=O)c1ccc(C(=O)Nc2ccc(Cl)cn2)c(NC(C(C)C)C2CCNCC2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 10/20 0.45
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ RECQL P46063 1/20 0.44
▸ KCNH2 Q12809 2/20 0.44
▸ RAB9A P51151 5/20 0.43
▸ NPC1 O15118 3/20 0.43
▸ TP53 P04637 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.42
▸ TSHR P16473 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ NFKB2 Q00653 1/20 0.41
▸ RELA Q04206 1/20 0.41

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
SCHEMBL7356229 0.94 F10 (0.48) F10MEN1KMT2ARECQLKCNH2
SCHEMBL6107051 0.92 F10 (0.47) F10MEN1KMT2ARECQLKCNH2
SCHEMBL6714678 0.84 NPC1 (0.53) F10RAB9ANPC1SMN1; SMN2ALOX15
Hydrochloric Acid SCHEMBL7356962 0.84 F10 (0.47) F10
Hydrochloric Acid SCHEMBL7358233 0.84 F10 (0.49) F10KCNH2
SCHEMBL6108227 0.82 CHEK1 (0.50) F10MEN1KMT2ARECQLKCNH2
Hydrochloric Acid SCHEMBL7446146 0.82 F10 (0.49) F10MEN1KMT2AKCNH2RAB9A
Hydrochloric Acid SCHEMBL6108557 0.80 F10 (0.59) F10MEN1KMT2ARECQLKCNH2
SCHEMBL7360451 0.80 AKT1 (0.47) F10MEN1KMT2ARECQLKCNH2
SCHEMBL7358439 0.79 F10 (0.51) F10KCNH2RAB9ANPC1KDM4E

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
EP-1140903-A1 AROMATIC AMIDES ELI LILLY AND COMPANY (US) 2001-10-10 — — EP disclosed
WO-2000039118-A1 AROMATIC AMIDES ELI LILLY AND COMPANY (US) 2000-07-06 — — WO disclosed
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