SCHEMBL10891760

SCHEMBL10891760

COC(=O)Oc1sc(OCCn2ccnc2)cc1C

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 8/20 0.49
KMT2A Q03164 2/20 0.49
KDM4E B2RXH2 2/20 0.47
PKM P14618 1/20 0.47
POLB P06746 2/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.46
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL10888480 0.91 TBXAS1 (0.49) TBXAS1KMT2AKDM4EPKMPOLB
Hydrochloric Acid SCHEMBL10888060 0.88 KDM4E (0.52) TBXAS1KMT2AKDM4EPKMPOLB
SCHEMBL10891544 0.82 TBXAS1 (0.55) TBXAS1KMT2AKDM4EALDH1A1LMNA
SCHEMBL10887353 0.82 TBXAS1 (0.47) TBXAS1KMT2AKDM4EPKMPOLB
SCHEMBL10857097 0.81 KMT2A (0.51) TBXAS1KMT2AKDM4EPKMPOLB
Hydrochloric Acid SCHEMBL11106558 0.81 KDM4E (0.51) TBXAS1KMT2AKDM4EPKMPOLB
SCHEMBL9768497 0.79 TBXAS1 (0.60) TBXAS1KMT2AKDM4EPKMPOLB
SCHEMBL10861223 0.78 KMT2A (0.53) TBXAS1KMT2AKDM4EPKMPOLB
Hydrochloric Acid SCHEMBL10859852 0.78 TBXAS1 (0.59) TBXAS1KMT2AKDM4EPKMPOLB
SCHEMBL10889824 0.76 GAA (0.36) KMT2A

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-0109381-B1 THIOPHENE-2-CARBOXYLIC-ACID DERIVATIVES AND PROCESS FOR THEIR PREPARATION Laevosan-Gesellschaft m.b.H. (AT) 1986-07-30 EP claimed
EP-0109381-A1 Thiophene-2-carboxylic-acid derivatives and process for their preparation Laevosan-Gesellschaft m.b.H. (AT) 1984-05-23 EP claimed
EP-0109381-B1 THIOPHENE-2-CARBOXYLIC-ACID DERIVATIVES AND PROCESS FOR THEIR PREPARATION Laevosan-Gesellschaft m.b.H. (AT) 1986-07-30 EP disclosed
EP-0109381-A1 Thiophene-2-carboxylic-acid derivatives and process for their preparation Laevosan-Gesellschaft m.b.H. (AT) 1984-05-23 EP disclosed