SCHEMBL14639639

SCHEMBL14639639

Cc1ccc2c(c1C)NCC(C)C2C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ KDM4E B2RXH2 2/20 0.50
▸ ALOX15 P16050 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.35
▸ GAPDH P04406 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ HSPA1A P0DMV8 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HSPA8 P11142 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ ALOX12 P18054 1/20 0.35
▸ NR4A1 P22736 1/20 0.35
▸ DUSP1 P28562 1/20 0.35
▸ APOBEC3A P31941 1/20 0.35
▸ PTPN7 P35236 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ BLM P54132 1/20 0.35
▸ MCL1 Q07820 1/20 0.35

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
SCHEMBL18854027 0.73 KDM4E (0.41) MEN1KMT2AKDM4EALOX15HSD17B10
SCHEMBL20910806 0.71 MEN1 (0.33) MEN1KMT2AKDM4EALOX15HSD17B10
SCHEMBL20910802 0.71 — —
SCHEMBL20910643 0.70 MEN1 (0.54) MEN1KMT2AKDM4EALOX15HSD17B10
SCHEMBL18672401 0.70 KDM4E (0.35) MEN1KMT2AKDM4EALOX15HSD17B10
SCHEMBL28517987 0.70 MEN1 (0.46) MEN1KMT2AKDM4EALOX15HSD17B10
SCHEMBL14485123 0.67 KDM4E (0.39) MEN1KMT2AKDM4EALOX15HSD17B10
SCHEMBL20991135 0.63 HTR2C (0.44) MEN1KMT2AKDM4EALOX15HSD17B10
SCHEMBL31607527 0.62 MEN1 (0.58) MEN1KMT2AKDM4EALOX15HSD17B10
SCHEMBL15730214 0.60 KDM4E (0.43) MEN1KMT2AKDM4EALOX15HSD17B10

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
EP-1739115-A1 RIGID HETEROCYCLIC POLYMER, METHOD FOR PRODUCING SAME, AND FIBER Teijin Techno Products Limited (JP) 2007-01-03 — — EP disclosed
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