SCHEMBL4779844

SCHEMBL4779844

CSc1ccccc1C1COCC[N]1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.33
HPGD P15428 4/20 0.33
RAB9A P51151 4/20 0.33
KDM4E B2RXH2 4/20 0.33
MAPT P10636 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
LMNA P02545 2/20 0.33
NISCH Q9Y2I1 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
HSD17B10 Q99714 1/20 0.31
NPC1 O15118 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
RXFP1 Q9HBX9 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL4979245 0.76 TAAR1 (0.49) ALDH1A1HPGDKDM4EMAPTSMN1; SMN2
SCHEMBL3173617 0.75 HTR2C (0.41) KMT2A
SCHEMBL4723659 0.73 KDM1A (0.45) ALDH1A1HPGDKDM4EMAPTNPSR1
SCHEMBL894904 0.71 TAAR1 (0.43) ALDH1A1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL2317406 0.70 HTR2C (0.40)
SCHEMBL4718986 0.70 KDM1A (0.32) ALDH1A1KDM4E
SCHEMBL7290779 0.69 ALDH1A1 (0.40) ALDH1A1KDM4EMAPTLMNAKMT2A
SCHEMBL11543072 0.69 TSHR (0.41) ALDH1A1HPGDRAB9AKDM4EMAPT
SCHEMBL5820333 0.67 CYP11B2 (0.36)
SCHEMBL4709666 0.66 ADRA2A (0.33) KDM4E

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-20160230049-A1 REVERSIBLE PRESSURE-SENSITIVE ADHESIVE MASS TESA SE (DE) 2016-08-11 US disclosed
US-7429409-B2 UV-crosslinking block copolymers TESA AG (DE) 2008-09-30 US disclosed
US-20050250906-A1 UV-crosslinking block copolymers TESA AG (DE) 2005-11-10 US disclosed