SCHEMBL14642404

SCHEMBL14642404

COc1cc(OC)cc(C(=O)Nc2ccc(Cl)c(-c3nc4ncccc4[nH]3)c2)c1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.64
▸ MEN1 O00255 2/20 0.55
▸ HTT P42858 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ PDE2A O00408 1/20 0.52
▸ PRMT5 O14744 1/20 0.52
▸ CASP3 P42574 1/20 0.48
▸ SENP8 Q96LD8 1/20 0.48
▸ SENP7 Q9BQF6 1/20 0.48
▸ SENP6 Q9GZR1 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ TP53 P04637 1/20 0.47

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
SCHEMBL13679579 0.90 PDE2A (0.53) MAPTMEN1KMT2APDE2APRMT5
SCHEMBL1268279 0.85 MAPT (0.85) MAPTMEN1HTTKMT2AKDM4E
SCHEMBL13679539 0.85 MAPT (0.67) MAPTMEN1HTTKMT2ACASP3
SCHEMBL13679575 0.82 MAPT (0.73) MAPTMEN1HTTKMT2AKDM4E
SCHEMBL13679580 0.81 MAPT (0.67) MAPTMEN1HTTKMT2AKDM4E
SCHEMBL13679552 0.81 MAPT (0.69) MAPTMEN1HTTKMT2AKDM4E
SCHEMBL16029174 0.80 MAPT (0.70) MAPTMEN1HTTKMT2AKDM4E
SCHEMBL14615282 0.80 MAPT (0.68) MAPTMEN1HTTKMT2AKDM4E
SCHEMBL14642415 0.80 MAPT (0.65) MAPTMEN1HTTKMT2AKDM4E
SCHEMBL15424127 0.79 MAPT (0.68) MAPTMEN1HTTKMT2AKDM4E

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-8772275-B2 Mediators of hedgehog signaling pathways, compositions and uses related thereto CURIS, INC. (US) 2014-07-08 — — US disclosed
US-8354397-B2 Controlling cell differentiation, cell proliferation; anticancer agents CURIS, INC. (US) 2013-01-15 — — US disclosed
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