SCHEMBL8418985

SCHEMBL8418985

CNc1ccc(C(=O)N(C)c2ccc(NC)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.57
▸ EGFR P00533 1/20 0.49
▸ ERBB2 P04626 1/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ SIRT2 Q8IXJ6 1/20 0.48
▸ RAB9A P51151 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ NR1H4 Q96RI1 1/20 0.46
▸ NR1H3 Q13133 2/20 0.45
▸ NR1H2 P55055 1/20 0.45
▸ HSP90AA1 P07900 1/20 0.45
▸ PDK2 Q15119 1/20 0.45
▸ NAMPT P43490 1/20 0.45
▸ ALDH1A1 P00352 3/20 0.44
▸ MAOA P21397 1/20 0.44
▸ MLYCD O95822 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ MAPT P10636 1/20 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
SCHEMBL30962500 0.91 ALDH1A1 (0.50) HTTEGFRERBB2KMT2AKDM4E
SCHEMBL8418603 0.91 HTT (0.50) HTTEGFRERBB2KMT2AKDM4E
SCHEMBL5013530 0.83 ALDH1A1 (0.55) HTTKDM4ENR1H4ALDH1A1SMN1; SMN2
SCHEMBL25660538 0.83 KMT2A (0.61) HTTKMT2AKDM4ERAB9ANPC1
SCHEMBL13002831 0.82 ALDH1A1 (0.61) HTTKMT2AKDM4ERAB9ANPC1
SCHEMBL12938525 0.79 HSD17B1 (0.57) HTTEGFRERBB2KMT2AKDM4E
SCHEMBL6802143 0.79 HSP90AA1 (0.60) HTTEGFRERBB2KMT2AKDM4E
SCHEMBL9094961 0.79 KMT2A (0.56) HTTEGFRERBB2KMT2AKDM4E
SCHEMBL9096918 0.78 NOTUM (0.65) HTTKMT2AKDM4ERAB9ANPC1
SCHEMBL24627774 0.78 MAPT (0.73) HTTKMT2AKDM4ERAB9ANPC1

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
EP-0573573-B1 MESOGENIC GLYCIDYL AMINES DOW CHEMICAL CO (US) 1999-09-29 — — EP claimed
EP-0573573-A1 MESOGENIC GLYCIDYL AMINES THE DOW CHEMICAL COMPANY (US) 1993-12-15 — — EP claimed
WO-1992015630-A2 MESOGENIC GLYCIDYL AMINES THE DOW CHEMICAL COMPANY (US) 1992-09-17 — — WO claimed
US-5360884-A Coatings, adhesives, moldings, laminates and encapsulation THE DOW CHEMICAL COMPANY (US) 1994-11-01 — — US disclosed
US-5262509-A Curable coatings THE DOW CHEMICAL COMPANY (US) 1993-11-16 — — US disclosed
Send feedback