SCHEMBL9813680

SCHEMBL9813680

CC1CC(C)(C)NC(C)(C)C1.O=C(O)Nc1cccc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.52
KDM4E B2RXH2 7/20 0.49
MAPT P10636 2/20 0.49
RAB9A P51151 3/20 0.47
CYP1A2 P05177 2/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2D6 P10635 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
NPC1 O15118 2/20 0.47
GAA P10253 2/20 0.47
ALDH1A1 P00352 3/20 0.46
GSK3B P49841 1/20 0.46
HPGD P15428 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
FABP7 O15540 2/20 0.45
MEN1 O00255 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
EPHX1 P07099 1/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL9813647 0.92 KMT2A (0.44) KMT2AKDM4EMAPTGAAALDH1A1
SCHEMBL10679466 0.92 KMT2A (0.44) KMT2AKDM4EMAPTGAAALDH1A1
Naphthoic Acid SCHEMBL9813601 0.80 KMT2A (0.62) KMT2AKDM4EMAPTGAAALDH1A1
SCHEMBL11051623 0.79 GAA (0.51) KMT2AKDM4EMAPTRAB9ACYP1A2
SCHEMBL194475 0.78 KDM4E (0.71) KMT2AKDM4EMAPTRAB9ACYP1A2
Hydrochloric Acid SCHEMBL11157390 0.77 KDM4E (0.69) KMT2AKDM4EMAPTRAB9ACYP1A2
Ammonia Solution, Strong SCHEMBL11430490 0.77 KDM4E (0.69) KMT2AKDM4EMAPTRAB9ACYP1A2
SCHEMBL10680690 0.73 HSD17B10 (0.42) KMT2AKDM4EMAPTRAB9ANPC1
SCHEMBL9813714 0.73 HSD17B10 (0.42) KMT2AKDM4EMAPTRAB9ANPC1
SCHEMBL11633371 0.72 KMT2A (0.44) KMT2AKDM4EMAPTRAB9ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0163245-B1 DERIVATIVES OF ALKYL-SUBSTITUTED 4-HYDROXY-METHYL-PIPERIDINE AND USE THEREOF AS STABILIZERS AUSIMONT S.r.l. (IT) 1991-07-31 EP disclosed
US-4772708-A STABILIZERS FOR POLYMERS AUSIMONT S.P.A. (IT) 1988-09-20 US disclosed
EP-0163245-A2 Derivatives of alkyl-substituted 4-hydroxy-methyl-piperidine and use thereof as stabilizers AUSIMONT S.r.l. (IT) 1985-12-04 EP disclosed