SCHEMBL6983387

SCHEMBL6983387

CC(C)COc1ccc2c(-c3cccnc3)csc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 5/20 0.41
CYP11B2 P19099 5/20 0.41
CYP19A1 P11511 2/20 0.41
MAP3K7 O43318 1/20 0.41
TAB1 Q15750 1/20 0.41
ALDH1A1 P00352 4/20 0.40
HSD17B10 Q99714 3/20 0.40
MAPT P10636 2/20 0.40
CYP17A1 P05093 2/20 0.40
PTK2 Q05397 1/20 0.39
KDM4E B2RXH2 2/20 0.39
HPGD P15428 2/20 0.39
GBA1 P04062 1/20 0.39
HTT P42858 1/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.38
CYP3A4 P08684 4/20 0.38
CYP2D6 P10635 2/20 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
Hydrochloric Acid SCHEMBL6983707 0.99 CYP11B1 (0.40) CYP11B1CYP11B2CYP19A1MAP3K7TAB1
SCHEMBL6985635 0.87 MAPT (0.56) CYP11B1CYP11B2CYP19A1MAP3K7TAB1
Hydrochloric Acid SCHEMBL6987032 0.86 MAPT (0.54) CYP11B1CYP11B2CYP19A1MAP3K7TAB1
SCHEMBL6979529 0.85 CYP2C9 (0.56) CYP11B1CYP11B2CYP19A1MAP3K7TAB1
SCHEMBL6987016 0.85 CYP19A1 (0.50) CYP11B1CYP11B2CYP19A1MAP3K7TAB1
SCHEMBL6984794 0.84 MKNK1 (0.44) CYP11B1CYP11B2CYP19A1MAP3K7TAB1
Hydrochloric Acid SCHEMBL6984061 0.84 CYP2C9 (0.55) CYP11B1CYP11B2CYP19A1MAP3K7TAB1
Hydrochloric Acid SCHEMBL6981896 0.84 CYP19A1 (0.49) CYP11B1CYP11B2CYP19A1MAP3K7TAB1
Hydrochloric Acid SCHEMBL6985178 0.83 MKNK1 (0.43) CYP11B1CYP11B2CYP19A1MAP3K7TAB1
SCHEMBL6982852 0.83 CYP2C9 (0.54) CYP11B1CYP11B2CYP19A1MAP3K7TAB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030130340-A1 Novel benzothiophene derivatives DAIICHI PHARMACEUTICAL CO. LTD. 2003-07-10 US disclosed
EP-1283209-A1 NOVEL BENZOTHIOPHENE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-02-12 EP 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 (1 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-20030130340-A1 Novel benzothiophene derivatives CYP17A1, CYP21A2, HSD17B1 CYP11B1 8/4885CYP11B2 18/4885CYP19A1 17/4885

“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.