SCHEMBL9025840

SCHEMBL9025840

CC(C)Cc1nc(OCc2ccccc2)c(COC2CCCCO2)nc1OCc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.40
DHFR P00374 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
HTR2C P28335 3/20 0.35
SLC6A4 P31645 3/20 0.35
HTR2A P28223 2/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34

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
SCHEMBL9026158 0.85 KDM4C (0.36) KDM4CDHFRNPC1RAB9AALDH1A1
SCHEMBL9026594 0.84 KDM4C (0.35) KDM4CDHFRNPC1RAB9AALDH1A1
SCHEMBL9026362 0.83 KDM4C (0.35) KDM4CNPC1RAB9AHTR2CSLC6A4
SCHEMBL17150203 0.76 KDM4C (0.42) KDM4CNPC1RAB9ATSHRMAPK1
SCHEMBL4184332 0.76 KDM4C (0.47) KDM4CMEN1KMT2APSEN1PSEN2
SCHEMBL11258174 0.75 KDM4C (0.46) KDM4CALDH1A1MEN1KMT2AEP300
SCHEMBL7445879 0.72 TACR1 (0.47) KDM4CALDH1A1TSHRMEN1KMT2A
SCHEMBL1563233 0.72 KDM4C (0.40) KDM4CDHFRNPC1RAB9AALDH1A1
SCHEMBL16815740 0.71 KDM4C (0.46) KDM4CDHFRNPC1RAB9AALDH1A1
SCHEMBL1564255 0.71 KDM4C (0.39) KDM4CDHFRSLC6A4MEN1KMT2A

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-0411150-B1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMA CO LTD (JP) 1996-11-27 EP disclosed