SCHEMBL6984794

SCHEMBL6984794

CC(C)Oc1ccc2c(-c3cccnc3)csc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.44
MKNK2 Q9HBH9 1/20 0.44
DYRK1A Q13627 1/20 0.41
DYRK1B Q9Y463 1/20 0.41
HPGD P15428 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 2/20 0.41
KDM4E B2RXH2 2/20 0.41
POLB P06746 1/20 0.40
MAP3K7 O43318 1/20 0.40
TAB1 Q15750 1/20 0.40
CYP3A4 P08684 5/20 0.40
CYP11B1 P15538 3/20 0.40
CYP11B2 P19099 3/20 0.40
CYP17A1 P05093 2/20 0.40
GPR35 Q9HC97 2/20 0.40
KMT2A Q03164 2/20 0.40
CYP1A1 P04798 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP1B1 Q16678 1/20 0.40

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 SCHEMBL6985178 0.99 MKNK1 (0.43) MKNK1MKNK2DYRK1ADYRK1BHPGD
SCHEMBL6985509 0.91 MKNK1 (0.46) MKNK1MKNK2DYRK1ADYRK1BHPGD
Hydrochloric Acid SCHEMBL6979381 0.90 MKNK1 (0.45) MKNK1MKNK2DYRK1ADYRK1BHPGD
SCHEMBL6981771 0.86 NPC1 (0.47) HPGDALDH1A1HSD17B10KDM4EPOLB
SCHEMBL6981655 0.86 KDM4E (0.55) HPGDALDH1A1HSD17B10KDM4ECYP3A4
Hydrochloric Acid SCHEMBL6982572 0.85 KDM4E (0.54) HPGDALDH1A1HSD17B10KDM4ECYP3A4
SCHEMBL6983387 0.84 CYP11B1 (0.41) HPGDALDH1A1HSD17B10KDM4EMAP3K7
Hydrochloric Acid SCHEMBL6983707 0.83 CYP11B1 (0.40) HPGDALDH1A1HSD17B10KDM4EMAP3K7
SCHEMBL6985635 0.82 MAPT (0.56) MKNK1MKNK2HPGDALDH1A1HSD17B10
Hydrochloric Acid SCHEMBL6987032 0.81 MAPT (0.54) MKNK1MKNK2HPGDALDH1A1HSD17B10

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 4113/4885DYRK1A 4799/4885

“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.