SCHEMBL8060600

SCHEMBL8060600

C=CCNC(=O)NCC=C.C=CCNC(=O)NCC=C

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
MAPT P10636 1/20 0.56
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 4/20 0.48
FAAH O00519 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
RAB9A P51151 1/20 0.43
HPGD P15428 3/20 0.42
LMNA P02545 2/20 0.42
HTT P42858 1/20 0.42
CYP1A2 P05177 1/20 0.41
PKM P14618 1/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL252121 1.00 TSHR (0.56) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL11367872 0.89
SCHEMBL5138597 0.88 SMN1; SMN2 (0.52) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL3182230 0.87
SCHEMBL17859667 0.86 SMN1; SMN2 (0.50) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL17859666 0.86 SMN1; SMN2 (0.50) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL3795914 0.86
SCHEMBL24132826 0.85 EPHX1 (0.52) TSHRSMN1; SMN2MAPTKMT2AFAAH
SCHEMBL4577617 0.85 TSHR (0.45) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL4577611 0.85 TSHR (0.45) TSHRSMN1; SMN2MAPTKMT2AALDH1A1

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
US-6136115-A INTRODUCING AMMONIUM DINITRAMIDE INTO PRILLING COLUMN ALLOWING IT TO FALL THROUGH THE HEATED ZONE TO FORM MELTED PARTICLES, SPHERIDIZING THE PREPILLS IN AN INERT FLUID MEDIUM, PASSING THROUGH COOLING ZONE TO HARDEN THE PRILLS CORDANT TECHNOLOGIES INC. (US) 2000-10-24 US claimed