SCHEMBL1637837

SCHEMBL1637837

CN/C(=C\c1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C1 Q04828 1/20 0.45
MTNR1A P48039 2/20 0.43
MTNR1B P49286 2/20 0.43
MAPT P10636 4/20 0.43
LMNA P02545 3/20 0.43
HTT P42858 3/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43
TSHR P16473 1/20 0.42
AKR1C3 P42330 1/20 0.42
PRMT1 Q99873 1/20 0.41
ESR1 P03372 1/20 0.41
NPSR1 Q6W5P4 4/20 0.40
CYP2D6 P10635 2/20 0.40
CYP2C9 P11712 2/20 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
SCHEMBL1637843 1.00 AKR1C1 (0.45) AKR1C1MTNR1AMTNR1BMAPTLMNA
SCHEMBL10584067 0.80 CYP1B1 (0.52) MAPTLMNAALDH1A1KDM4EMEN1
SCHEMBL13066991 0.79 TDP1 (0.41) MAPTALDH1A1KDM4EMEN1HPGD
SCHEMBL21982059 0.78 MEN1 (0.43) AKR1C1MTNR1AMTNR1BMAPTLMNA
SCHEMBL7646245 0.77 MAPT (0.59) AKR1C1MAPTLMNAHTTALDH1A1
SCHEMBL1492165 0.77 MAPT (0.59) AKR1C1MAPTLMNAHTTALDH1A1
SCHEMBL10006566 0.76 MTNR1A (0.54) AKR1C1MTNR1AMTNR1BMAPTLMNA
SCHEMBL11513786 0.76 MTNR1A (0.54) AKR1C1MTNR1AMTNR1BMAPTLMNA
Dimethylamine SCHEMBL9317351 0.76 ESR1 (0.63) AKR1C1MTNR1AMTNR1BMAPTLMNA
SCHEMBL12337184 0.76 TDP1 (0.38) MAPTLMNAALDH1A1KDM4EMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8536242-B2 Photocurable composition SEKISUI CHEMICAL CO., LTD. (JP) 2013-09-17 US disclosed
US-20110097669-A1 PHOTOCURABLE COMPOSITION SEKISUI CHEMICAL CO., LTD. (JP) 2011-04-28 US disclosed