SCHEMBL14615277

SCHEMBL14615277

Cc1ccc(-c2nc3ccccc3[nH]2)cc1NC(=O)c1oc2ccccc2c1C

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 6/20 0.65
▸ KMT2A Q03164 6/20 0.65
▸ KDM4E B2RXH2 5/20 0.65
▸ RAB9A P51151 4/20 0.65
▸ MEN1 O00255 4/20 0.65
▸ NPC1 O15118 3/20 0.65
▸ HTT P42858 3/20 0.65
▸ LMNA P02545 2/20 0.65
▸ NFKB1 P19838 1/20 0.65
▸ CCR6 P51684 1/20 0.65
▸ NFKB2 Q00653 1/20 0.65
▸ RELA Q04206 1/20 0.65
▸ MAPT P10636 14/20 0.61
▸ ALDH1A1 P00352 6/20 0.61
▸ HPGD P15428 3/20 0.61
▸ CYP1A2 P05177 2/20 0.61
▸ CYP3A4 P08684 2/20 0.61
▸ CYP2C19 P33261 2/20 0.61
▸ CYP2C9 P11712 1/20 0.61
▸ CYP2D6 P10635 1/20 0.59

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
SCHEMBL27202488 0.82 DDX3X (0.73) SMN1; SMN2KMT2AKDM4ERAB9AMEN1
SCHEMBL4400767 0.77 MAPT (0.63) SMN1; SMN2KMT2AKDM4ERAB9AMEN1
SCHEMBL14615293 0.77 MAPT (0.72) SMN1; SMN2KMT2AKDM4ERAB9AMEN1
SCHEMBL13679553 0.76 MAPT (0.71) SMN1; SMN2KMT2AKDM4ERAB9AMEN1
SCHEMBL13679550 0.75 MAPT (0.70) SMN1; SMN2KMT2AKDM4ERAB9AMEN1
SCHEMBL17354449 0.74 THRB (0.68) SMN1; SMN2KMT2AKDM4ERAB9AMEN1
SCHEMBL16782299 0.74 MAPT (1.00) SMN1; SMN2KMT2AKDM4ERAB9AMEN1
SCHEMBL14615292 0.74 MAPT (0.69) SMN1; SMN2KMT2AKDM4ERAB9AMEN1
SCHEMBL13679543 0.73 MAPT (0.79) SMN1; SMN2KMT2AMEN1NPC1HTT
SCHEMBL14615278 0.72 MAPT (1.00) SMN1; SMN2KMT2AMEN1NPC1MAPT

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-8354397-B2 Controlling cell differentiation, cell proliferation; anticancer agents CURIS, INC. (US) 2013-01-15 — — US disclosed
US-8354397-B2 Controlling cell differentiation, cell proliferation; anticancer agents CURIS, INC. (US) 2013-01-15 — — US disclosed
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