SCHEMBL8360805

SCHEMBL8360805

CCn1c(-c2ccc(N(C)C)cc2)nnc1-c1ccc(N(C)C)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.58
MAPT P10636 6/20 0.58
RAB9A P51151 4/20 0.58
KDM4E B2RXH2 4/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
NPC1 O15118 3/20 0.58
HPGD P15428 3/20 0.58
HTT P42858 3/20 0.58
GFER P55789 2/20 0.58
MEN1 O00255 1/20 0.58
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
KMT2A Q03164 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.43
LMNA P02545 4/20 0.43
MAPK1 P28482 2/20 0.43
HSD17B10 Q99714 3/20 0.42

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
SCHEMBL10414046 0.78 ALDH1A1 (0.54) ALDH1A1MAPTRAB9AKDM4ESMN1; SMN2
SCHEMBL5998300 0.75 ALDH1A1 (0.56) ALDH1A1MAPTRAB9AKDM4ESMN1; SMN2
SCHEMBL18969862 0.74 KDM4E (1.00) ALDH1A1MAPTRAB9AKDM4ESMN1; SMN2
SCHEMBL23954186 0.73 ALDH1A1 (0.47) ALDH1A1MAPTRAB9AKDM4ESMN1; SMN2
SCHEMBL11547412 0.68 ALDH1A1 (0.79) ALDH1A1MAPTSMN1; SMN2HPGDMEN1
SCHEMBL124209 0.68 ALDH1A1 (0.79) ALDH1A1MAPTSMN1; SMN2HPGDMEN1
SCHEMBL16264702 0.68 HDAC8 (0.54) ALDH1A1MAPTRAB9AKDM4ENPC1
SCHEMBL1544438 0.68 MEN1 (0.47) ALDH1A1MAPTRAB9AKDM4ESMN1; SMN2
SCHEMBL14077056 0.67 TSHR (0.59) ALDH1A1MAPTRAB9AKDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL31707017 0.66 ALDH1A1 (0.73) ALDH1A1MAPTSMN1; SMN2HPGDMEN1

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
US-5856013-A CHARGE TRANSPORT LAYER AND A FLUORINATED CARBON FILLED FLUOROELASTOMER LAYER. XEROX CORPORATION 1999-01-05 US disclosed
US-4431722-A POLYCYCLIC QUINONE PIGMENT DISPERSED IN A RESIN BINDER AS CHARGE GENERATING LAYER; ANTIFOGGING AGENTS KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1984-02-14 US disclosed
US-4338222-A Semiconductive organic compositions XEROX CORPORATION (US) 1982-07-06 US disclosed