SCHEMBL13679566

SCHEMBL13679566

O=C(Nc1ccc(Cl)c(-c2nc3cc(Cl)ccc3[nH]2)c1)c1ccc2c(c1)OCCO2

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.73
▸ MEN1 O00255 3/20 0.73
▸ KMT2A Q03164 3/20 0.73
▸ KDM4E B2RXH2 2/20 0.73
▸ ALDH1A1 P00352 1/20 0.73
▸ HTT P42858 1/20 0.73
▸ LMNA P02545 1/20 0.60
▸ MAOB P27338 7/20 0.58
▸ THRB P10828 1/20 0.56
▸ RAB9A P51151 4/20 0.55
▸ NPC1 O15118 3/20 0.55
▸ POLB P06746 2/20 0.55
▸ CYP3A4 P08684 1/20 0.52
▸ CYP2D6 P10635 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52

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
SCHEMBL14642444 0.91 MAPT (0.70) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL13679564 0.91 MAPT (0.70) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL13679558 0.91 MEN1 (0.72) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL14615273 0.90 MAPT (0.89) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL14615301 0.89 MAPT (0.67) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL14642407 0.89 MAPT (0.67) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL14642489 0.88 MEN1 (0.69) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL14615283 0.87 MEN1 (0.68) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL14642408 0.87 MAPT (0.70) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL13679556 0.87 MAPT (0.68) MAPTMEN1KMT2AKDM4EALDH1A1

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 5 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-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
US-8354397-B2 Controlling cell differentiation, cell proliferation; anticancer agents CURIS, INC. (US) 2013-01-15 — — US disclosed
EP-1482928-B1 MEDIATORS OF HEDGEHOG SIGNALING PATHWAYS,COMPOSITIONS AND USES RELATED THERETO CURIS INC (US) 2009-09-23 — — EP disclosed
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