SCHEMBL11275045

SCHEMBL11275045

CN(C(=O)N(c1ccccc1)C1CCCCC1)C1CCCCC1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.59
▸ NPC1 O15118 3/20 0.59
▸ KMT2A Q03164 3/20 0.59
▸ RAB9A P51151 2/20 0.59
▸ KDM4E B2RXH2 2/20 0.59
▸ MEN1 O00255 2/20 0.59
▸ MITF O75030 1/20 0.59
▸ PAX8 Q06710 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ ATM Q13315 1/20 0.55
▸ TRPM8 Q7Z2W7 5/20 0.55
▸ HPGD P15428 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ ABCC1 P33527 2/20 0.49
▸ PKM P14618 1/20 0.48
▸ LMNA P02545 1/20 0.45

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
SCHEMBL11274060 0.89 KDM4E (0.60) ALDH1A1NPC1KMT2ARAB9AKDM4E
SCHEMBL11282486 0.85 ATM (0.56) ALDH1A1NPC1KMT2ARAB9AKDM4E
SCHEMBL5332530 0.85 ATM (0.56) ALDH1A1NPC1KMT2ARAB9AKDM4E
SCHEMBL6601536 0.81 KDM4E (0.64) ALDH1A1NPC1KMT2ARAB9AKDM4E
SCHEMBL6215102 0.81 KDM4E (0.68) ALDH1A1NPC1KMT2ARAB9AKDM4E
SCHEMBL2395969 0.80 ALDH1A1 (0.66) ALDH1A1NPC1KMT2ARAB9AKDM4E
SCHEMBL11407980 0.79 MEN1 (0.65) ALDH1A1NPC1KMT2ARAB9AKDM4E
SCHEMBL11282487 0.79 KDM4E (0.57) ALDH1A1NPC1KMT2ARAB9AKDM4E
SCHEMBL11430874 0.78 ALDH1A1 (0.64) ALDH1A1NPC1KMT2ARAB9AKDM4E
SCHEMBL7107150 0.78 KDM4E (0.69) ALDH1A1NPC1KMT2ARAB9AKDM4E

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4349526-A TRI-SUBSTITUTED PHENYLUREAS AS SOLVENT IN ANTHRAQUINONE PROCESS DEGUSSA AKTIENGESELLSCHAFT (DE) 1982-09-14 — — US disclosed
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