SCHEMBL7123801

SCHEMBL7123801

Cc1ccc(CNCc2cccc3c2C(S(=O)(=O)c2ccccc2)CS3(=O)=O)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
CA12 O43570 2/20 0.36
CA9 Q16790 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 1/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 1/20 0.33
KDM4E B2RXH2 1/20 0.33
PKM P14618 1/20 0.33
CYP19A1 P11511 1/20 0.33
CXCR4 P61073 1/20 0.32

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 SCHEMBL7154721 0.99 CA1 (0.36) RAB9ANPC1CA12CA9CYP1A2
SCHEMBL7132604 0.92 CA1 (0.37) CA12CA9CA1CA2SMN1; SMN2
SCHEMBL7129842 0.90 CA1 (0.36) CA12CA9MAPTCA1CA2
SCHEMBL7128520 0.90 SMN1; SMN2 (0.38) CA12CA9CA1CA2SMN1; SMN2
SCHEMBL7128692 0.89 CA2 (0.49) CA12CA9CA1CA2
SCHEMBL7123797 0.89 NPC1 (0.38) RAB9ANPC1CA12CA9CYP1A2
Hydrochloric Acid SCHEMBL7154728 0.88 NPC1 (0.37) RAB9ANPC1CA12CA9CYP1A2
SCHEMBL7136031 0.86 HTR6 (0.38) CA12L3MBTL1MAPTCA1CA2
Hydrochloric Acid SCHEMBL7126775 0.85 HTR6 (0.38) CA12L3MBTL1MAPTCA1CA2
SCHEMBL7130587 0.85 L3MBTL1 (0.37) CA12CA9CYP3A4L3MBTL1SMN1; SMN2

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-20030073706-A1 Fused thiophone derivatives and drugs containing the same as the active ingredient KONISHI MIKIO (JP) 2003-04-17 US claimed
US-6420391-B1 PREVENTION AND/OR TREATMENT OF VARIOUS INFLAMMATORY DISEASES, SEPSIS, MULTIPLE MYELOMA, PLASMA CELL LEUKEMIA, OSTEOPOROSIS, CACHEXIA, PSORIASIS, NEPHRITIS, RENAL CELL CARCINOMA, KAPOSI'S SARCOMA, RHEUMATOID ARTHRITIS, GAMMOPATHY, CASTLEMAN'S ONO PHARMACEUTICAL CO., LTD. (JP) 2002-07-16 US claimed
EP-1067128-A1 FUSED THIOPHENE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2001-01-10 EP claimed

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-20030073706-A1 Fused thiophone derivatives and drugs containing the same as the active ingredient TPMT, CD47, THPO RAB9A 4644/4885NPC1 4435/4885CA12 838/4885

“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.