SCHEMBL8523151

SCHEMBL8523151

CCCCCN1CNc2cc(C#N)ccc21

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.40
DRD3 P35462 4/20 0.40
HDAC1 Q13547 1/20 0.37
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CASP3 P42574 1/20 0.35
RARB P10826 1/20 0.34
RARG P13631 1/20 0.34
SOD3 P08294 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ICMT O60725 1/20 0.33

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
SCHEMBL8523698 0.79 HDAC1 (0.39) HDAC1KDM4E
SCHEMBL9041570 0.79 HDAC1 (0.39) HDAC1HSD17B10SOD3ALDH1A1MAPT
SCHEMBL9038436 0.79 HDAC1 (0.39) HDAC1HSD17B10SOD3ALDH1A1MAPT
SCHEMBL9482390 0.77 DRD2 (0.44) DRD2DRD3TSHRHSD17B10CASP3
SCHEMBL8523710 0.77 SCN9A (0.39) HDAC1KDM4EALDH1A1
SCHEMBL31542281 0.74 KDM4E (0.39) DRD2DRD3HDAC1CASP3KDM4E
SCHEMBL9038711 0.74 CES1 (0.44) KDM4EALDH1A1
SCHEMBL8524212 0.73 SIGMAR1 (0.38) HDAC1SOD3KDM4E
SCHEMBL11331903 0.73 CYP2A6 (0.38) DRD2DRD3ALDH1A1
SCHEMBL24316519 0.70 KDM4E (0.43) DRD2DRD3CASP3KDM4EALDH1A1

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-5968725-A MATERIAL COMPRISING ON SUPPORT SILVER HALIDE PHOTOSENSITIVE LAYER CONTAINING ORGANIC SILVER SALT, REDUCING AGENT, ULTRAHIGH CONTRAST PROMOTING AGENT, SELECTED HETEROCYCLIC MERCAPTO COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1999-10-19 US disclosed
US-5236807-A Negative, hydrazine compound FUJI PHOTO FILM CO., LTD. (JP) 1993-08-17 US disclosed
US-4769316-A Method for restraining the formation of re-reversal negative image in direct positive silver halide photographic materials FUJI PHOTO FILM CO., LTD. (JP) 1988-09-06 US disclosed