SCHEMBL6986460

SCHEMBL6986460

CC(=O)c1ccc(-c2ccc3c(-c4cccnc4)csc3c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 6/20 0.46
MKNK2 Q9HBH9 6/20 0.46
RAB9A P51151 3/20 0.44
KMT2A Q03164 2/20 0.44
NPC1 O15118 2/20 0.44
MEN1 O00255 1/20 0.44
PIK3CA P42336 1/20 0.44
PIK3CG P48736 1/20 0.44
SLC2A1 P11166 1/20 0.43
CYP19A1 P11511 1/20 0.43
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2A6 P11509 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GPR35 Q9HC97 1/20 0.42
LIMK1 P53667 1/20 0.41

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
SCHEMBL6978131 0.92 MEN1 (0.51) MKNK2RAB9AKMT2ANPC1MEN1
SCHEMBL6985095 0.86 CYP11B1 (0.45) MKNK1MKNK2RAB9ANPC1PIK3CA
SCHEMBL6985848 0.86 DYRK1A (0.50) MKNK1MKNK2MEN1PIK3CAPIK3CG
Hydrochloric Acid SCHEMBL6985047 0.84 CYP11B1 (0.44) MKNK1MKNK2RAB9ANPC1PIK3CA
SCHEMBL6985680 0.83 CYP19A1 (0.50) RAB9ANPC1PIK3CACYP19A1CYP11B1
Hydrochloric Acid SCHEMBL6984402 0.82 ALOX5AP (0.42) RAB9AKMT2ANPC1MEN1PIK3CA
SCHEMBL6989142 0.82 CYP17A1 (0.50) RAB9AKMT2ANPC1MEN1PIK3CA
SCHEMBL6987081 0.81 MAP3K7 (0.40) PIK3CAPIK3CGCYP11B1CYP3A4CYP2A6
SCHEMBL6982148 0.81 CYP11B2 (0.52) RAB9ANPC1CYP19A1CYP11B1CYP11B2
SCHEMBL6983318 0.81 NPC1 (0.51) RAB9AKMT2ANPC1MEN1PIK3CA

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 MKNK1 3971/4885MKNK2 4113/4885RAB9A 4646/4885

“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.