SCHEMBL9558342

SCHEMBL9558342

CC(C)ON=CCc1cccs1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.40
HTT P42858 1/20 0.36
RAB9A P51151 2/20 0.36
HPGD P15428 1/20 0.36
TAAR1 Q96RJ0 1/20 0.35
ADRA2A P08913 2/20 0.35
ADRA2B P18089 2/20 0.35
ADRA2C P18825 2/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HRH3 Q9Y5N1 2/20 0.34
PKM P14618 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL7878676 0.81 TAAR1 (0.38) SMN1; SMN2HTTRAB9ATAAR1ADRA2A
SCHEMBL9558559 0.78 HPGD (0.38) SMN1; SMN2RAB9AHPGDTAAR1ADRA2A
SCHEMBL9558609 0.78 HPGD (0.38) SMN1; SMN2RAB9AHPGDTAAR1ADRA2A
SCHEMBL9744645 0.75 ALDH1A1 (0.38) SMN1; SMN2RAB9AHPGDTAAR1ADRA2A
SCHEMBL24922344 0.74
SCHEMBL6983487 0.74 POLB (0.41) SMN1; SMN2RAB9AHPGDADRA2AADRA2B
SCHEMBL15347875 0.74 POLB (0.41) SMN1; SMN2RAB9AHPGDADRA2AADRA2B
SCHEMBL9557896 0.73 ALDH1A1 (0.45) SMN1; SMN2RAB9AHPGDTAAR1CYP2C19
SCHEMBL13946975 0.72 HTT (0.40) SMN1; SMN2HTTRAB9AHPGDTAAR1
SCHEMBL9558974 0.71 SLC6A3 (0.33)

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-0245835-B1 NOVEL THIOPHENE DERIVATIVES AND METHODS FOR PRODUCING THE SAME SEITETSU KAGAKU CO., LTD. (JP) 1993-05-05 EP disclosed
US-5101049-A Novel thiophene derivatives and methods for producing the same SEITETSU KAGAKU CO., LTD. (JP) 1992-03-31 US disclosed
US-4792612-A MEDICINE INTERMEDIATES SEITETSU KAGAKU CO., LTD. (JP) 1988-12-20 US disclosed
EP-0245835-A2 Novel thiophene derivatives and methods for producing the same SEITETSU KAGAKU CO., LTD. (JP) 1987-11-19 EP disclosed