SCHEMBL7986532

SCHEMBL7986532

CCCCc1c(N2CCN(Cc3ccccc3)CC2)ccc2c1C(=O)NC2=O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
MAPK1 P28482 3/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
MAPT P10636 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
DRD4 P21917 5/20 0.43
DRD2 P14416 4/20 0.43
DRD3 P35462 4/20 0.43
GAA P10253 1/20 0.43
ALDH1A1 P00352 4/20 0.42
TRPC5 Q9UL62 1/20 0.42
PRMT1 Q99873 1/20 0.41
HTT P42858 3/20 0.41
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
NCF1 P14598 1/20 0.40

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
Hydrochloric Acid SCHEMBL7727011 0.82 KDM4E (0.43) TSHRMAPK1MEN1KMT2ANPSR1
SCHEMBL7986396 0.78 DRD4 (0.44) TSHRMAPK1MEN1KMT2ANPSR1
SCHEMBL7983137 0.77 RAB9A (0.41) MAPK1KMT2AMAPTDRD3ALDH1A1
SCHEMBL8828519 0.76 TNKS2 (0.55) TSHRMEN1KMT2AMAPTTDP1
SCHEMBL5996608 0.70 PARP1 (0.39) TSHRMAPK1MEN1KMT2ANPSR1
SCHEMBL7986389 0.70 CCR3 (0.50) KMT2AALDH1A1
SCHEMBL10624906 0.70 TYMP (0.41) MAPTALDH1A1HTT
Hydrochloric Acid SCHEMBL7723748 0.69 PARP1 (0.38) TSHRMAPK1MEN1KMT2ANPSR1
SCHEMBL7986525 0.69 CCR3 (0.56)
SCHEMBL28597691 0.68 ELANE (0.40) MAPTALDH1A1HTTSMN1; SMN2

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-6235731-B1 REDUCING BLOOD LIPIDS, SUGARS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-05-22 US disclosed