SCHEMBL10934699

SCHEMBL10934699

CN(CCC[NH])CCCN(Cc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1)Cc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ KDM4E B2RXH2 1/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ CYP2D6 P10635 1/20 0.53
▸ CYP2C9 P11712 1/20 0.53
▸ BLM P54132 1/20 0.53
▸ BCHE P06276 7/20 0.43
▸ CCR5 P51681 1/20 0.41
▸ SMPD1 P17405 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ TRPM8 Q7Z2W7 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40

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
SCHEMBL10934704 0.88 MEN1 (0.54) MEN1KMT2AKDM4ECYP1A2CYP3A4
SCHEMBL10939304 0.81 SLC2A1 (0.56) MEN1KMT2AKDM4ECYP1A2CYP3A4
SCHEMBL10939250 0.78 MEN1 (0.51) MEN1KMT2AKDM4ECYP1A2CYP3A4
SCHEMBL11012019 0.78 MEN1 (0.52) MEN1KMT2AKDM4ECYP1A2CYP3A4
SCHEMBL10934694 0.77 MEN1 (0.47) MEN1KMT2AKDM4ECYP1A2CYP3A4
SCHEMBL10941359 0.74 KMT2A (0.48) MEN1KMT2AKDM4ECYP1A2CYP3A4
SCHEMBL9416643 0.73 KDM4E (0.81) MEN1KMT2AKDM4ECYP1A2CYP3A4
SCHEMBL7802750 0.72 SLC2A1 (0.54) MEN1KMT2AKDM4ECYP1A2CYP3A4
SCHEMBL19194551 0.71 KDM4E (0.59) MEN1KMT2AKDM4ECYP1A2CYP3A4
SCHEMBL3236287 0.71 SLC2A1 (0.52) MEN1KMT2AKDM4ECYP1A2CYP3A4

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-4500452-A NOT SUBJECT TO ENZYME DEACTIVATION NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1985-02-19 — — US disclosed
US-4472304-A CARCINOSTATIC NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1984-09-18 — — US disclosed
Send feedback