SCHEMBL10885482

SCHEMBL10885482

NC(=O)[C@@](N)(CO)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
KMT2A Q03164 1/20 0.50
HTT P42858 1/20 0.46
KCNN4 O15554 8/20 0.44
CYP2D6 P10635 2/20 0.41
CYP1A2 P05177 2/20 0.41
HIF1A Q16665 2/20 0.39
CYP2C19 P33261 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
KCNH2 Q12809 1/20 0.39
KDM4E B2RXH2 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
POLB P06746 1/20 0.38
CYP3A4 P08684 1/20 0.38
PARP1 P09874 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL1712450 0.85 CYP1A2 (0.47) MAPTKMT2AHTTKCNN4CYP2D6
SCHEMBL1712451 0.85 CYP1A2 (0.47) MAPTKMT2AHTTKCNN4CYP2D6
SCHEMBL1712531 0.85 CYP1A2 (0.47) MAPTKMT2AHTTKCNN4CYP2D6
SCHEMBL28020444 0.84 MAPT (0.47) MAPTKMT2AHTTKCNN4CYP2D6
Hydrochloric Acid SCHEMBL8064648 0.83 CYP1A2 (0.46) MAPTKMT2AHTTKCNN4CYP2D6
SCHEMBL6994278 0.82 KMT2A (0.53) MAPTKMT2AHTTKCNN4CYP2D6
SCHEMBL15228216 0.82 MAPT (0.48) MAPTKMT2AHTTKCNN4CYP2D6
SCHEMBL27979604 0.80 SMN1; SMN2 (0.55) MAPTKMT2AHTTKCNN4CYP2D6
SCHEMBL5793007 0.79 KMT2A (0.50) MAPTKMT2AHTTKCNN4CYP2D6
SCHEMBL29730901 0.79 MAPT (0.46) MAPTKMT2AHTTKCNN4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0071926-B1 NEW RIBOFURANURONIC ACID DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-10-08 EP claimed
EP-0071926-A1 New ribofuranuronic acid derivatives, processes for preparation thereof and pharmaceutical compositions thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-02-16 EP claimed
EP-0071926-B1 NEW RIBOFURANURONIC ACID DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-10-08 EP disclosed
US-4479942-A Tetrahydrofurnancarboxylic acid derivatives, processes for preparation thereof and pharmaceutical compositions thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-10-30 US disclosed