SCHEMBL13026656

SCHEMBL13026656

CSc1ccc(Cc2ccc(SC)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 13/20 0.56
SLC6A2 P23975 3/20 0.55
SLC6A3 Q01959 3/20 0.55
MAOA P21397 1/20 0.54
ALDH1A1 P00352 1/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
NPC1 O15118 1/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL1106683 0.90 MEN1 (0.60) SLC6A4SLC6A2SLC6A3MAOAALDH1A1
SCHEMBL27613417 0.90 SLC6A4 (0.58) SLC6A4SLC6A2SLC6A3MAOAALDH1A1
SCHEMBL28112542 0.86 SLC6A4 (0.50) SLC6A4SLC6A2SLC6A3MAOAALDH1A1
SCHEMBL10872284 0.81 KMT2A (0.73) SLC6A4SLC6A2SLC6A3ALDH1A1KMT2A
SCHEMBL83839 0.80 ALDH1A1 (0.58) SLC6A4SLC6A2SLC6A3MAOAALDH1A1
SCHEMBL257109 0.80 MEN1 (0.55) SLC6A4SLC6A2SLC6A3MAOAMEN1
SCHEMBL7329722 0.79 SLC6A4 (0.63) SLC6A4SLC6A2SLC6A3ALDH1A1MEN1
SCHEMBL3233609 0.78 TAAR1 (0.47) SLC6A4SLC6A2SLC6A3MAOAALDH1A1
SCHEMBL1632507 0.78 MAPT (0.45) SLC6A4SLC6A2SLC6A3MAOAALDH1A1
SCHEMBL115662 0.78 SLC6A4 (0.40) SLC6A4SLC6A2SLC6A3MAOAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170173938-A1 PHOTOSENSITIVE RESIN COMPOSITION, PLANOGRAPHIC PRINTING PLATE PRECURSOR, METHOD FOR PRODUCING PLANOGRAPHIC PRINTING PLATE, AND POLYMER COMPOUND FUJIFILM CORPORATION (JP) 2017-06-22 US disclosed
US-8470917-B2 Production method of polyimide solution and fluorinated polyimide solution NIPPON SHOKUBAI CO., LTD. (JP) 2013-06-25 US disclosed
US-8470917-B2 Production method of polyimide solution and fluorinated polyimide solution NIPPON SHOKUBAI CO., LTD. (JP) 2013-06-25 US disclosed
US-20100284664-A1 Production method of polyimide solution and fluorinated polyimide solution NIPPON SHOKUBAI CO., LTD. (JP) 2010-11-11 US disclosed
US-20100284664-A1 Production method of polyimide solution and fluorinated polyimide solution NIPPON SHOKUBAI CO., LTD. (JP) 2010-11-11 US disclosed
US-7700647-B2 Fluorinated bis (phthalic anhydride) and method for producing the same NIPPON SHOKUBAI CO., LTD. (JP) 2010-04-20 US disclosed
US-7700647-B2 Fluorinated bis (phthalic anhydride) and method for producing the same NIPPON SHOKUBAI CO., LTD. (JP) 2010-04-20 US disclosed
US-20080119659-A1 Fluorinated bis (phthalic anhydride) and method for producing the same MASUDA GO 2008-05-22 US disclosed
US-20080119659-A1 Fluorinated bis (phthalic anhydride) and method for producing the same MASUDA GO 2008-05-22 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 (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-20080119659-A1 Fluorinated bis (phthalic anhydride) and method for producing the same FHIT, PBRM1, INF2 SLC6A4 3364/4885SLC6A2 3875/4885SLC6A3 4426/4885

“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.