SCHEMBL4064890

SCHEMBL4064890

O=C(O)c1ccccc1Sc1csc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.50
RAB9A P51151 4/20 0.48
PKM P14618 2/20 0.48
RXFP1 Q9HBX9 1/20 0.48
CYP1A2 P05177 1/20 0.47
KDM4E B2RXH2 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
ALDH1A1 P00352 1/20 0.47
CNR2 P34972 1/20 0.45
HDAC3 O15379 1/20 0.45
HDAC4 P56524 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45
HDAC5 Q9UQL6 1/20 0.45

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
SCHEMBL4618325 0.88 ALDH1A1 (0.44) POLBRAB9APKMRXFP1CYP1A2
SCHEMBL4058374 0.86 SIRT1 (0.54) POLBRAB9APKMRXFP1CYP1A2
SCHEMBL4068959 0.83 CSNK2A1 (0.44) POLBRAB9APKMRXFP1KDM4E
SCHEMBL4059186 0.83 MAOB (0.43) RAB9APKMKDM4EALDH1A1HDAC3
SCHEMBL21704789 0.83 KDM4E (0.44) POLBRAB9APKMRXFP1CYP1A2
SCHEMBL4068766 0.82 HSD17B10 (0.51) POLBPKMCYP1A2KDM4ETDP1
SCHEMBL1482567 0.80 POLB (0.74) POLBRAB9APKMRXFP1CYP1A2
SCHEMBL29888792 0.80 POLB (0.74) POLBRAB9APKMRXFP1CYP1A2
SCHEMBL1801896 0.80 CYP2A6 (0.50) RAB9APKMKDM4ETDP1ALDH1A1
SCHEMBL9460748 0.78 POLB (0.71) POLBRAB9APKMRXFP1CYP1A2

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-20090192213-A1 Benzo[b]furane And Benzo[b]thiophene Derivatives H. LUNDBECK A/S (DK) 2009-07-30 US disclosed
US-7534791-B2 Benzo[b]furane and benzo[b]thiophene derivatives H. LUNDBECK A/S (DK) 2009-05-19 US disclosed
US-20060287386-A1 Benzo[b]furane and benzo[b]thiophene derivatives H. LUNDBECK A/S (DK) 2006-12-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060287386-A1 Benzo[b]furane and benzo[b]thiophene derivatives CYP1B1, TBCB, CYP4B1 POLB 294/4885RAB9A 2251/4885PKM 2728/4885
US-20090192213-A1 Benzo[b]furane And Benzo[b]thiophene Derivatives CYP1B1, TBCB, CYP4B1 POLB 294/4885RAB9A 2251/4885PKM 2728/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.