SCHEMBL177832

SCHEMBL177832

CCC(CS)c1cccnc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
SLC6A3 Q01959 1/20 0.46
GOPC Q9HD26 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 1/20 0.41
CYP19A1 P11511 2/20 0.41
GAA P10253 1/20 0.40
KCNA5 P22460 3/20 0.38
KCNN4 O15554 2/20 0.38
KCNH2 Q12809 1/20 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
SCHEMBL12154822 0.88 CFTR (0.52) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL7523392 0.86 SMN1; SMN2 (0.43) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL18947499 0.81 CFTR (0.46) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL2567204 0.79 SMN1; SMN2 (0.50) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL14168820 0.79 SMN1; SMN2 (0.43) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL1245579 0.79 L3MBTL1 (0.46) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL14479168 0.77 L3MBTL1 (0.49) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL12124045 0.77 SMN1; SMN2 (0.42) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL16919628 0.77 CFTR (0.48) CFTRSLC6A2SLC6A4SLC6A3GOPC
SCHEMBL178057 0.77 CFTR (0.48) CFTRSLC6A2SLC6A4SLC6A3GOPC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2390243-B1 PROCESS FOR PREPARING BISPHENOL MITSUBISHI CHEM CORP (JP) 2020-07-08 EP disclosed
US-8445731-B2 Process for producing bisphenol compound MITSUBISHI CHEMICAL CORPORATION (JP) 2013-05-21 US disclosed
US-20120010434-A1 PROCESS FOR PRODUCING BISPHENOL COMPOUND MITSUBISHI CHEMICAL CORPORATION (JP) 2012-01-12 US disclosed
EP-2390243-A1 PROCESS FOR PREPARING BISPHENOL Mitsubishi Chemical Corporation (JP) 2011-11-30 EP disclosed
US-20110256982-A1 INTERLOCK CIRCUIT FOR UTILITY VEHICLE PARK BRAKE DEERE & COMPANY 2011-10-20 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-20120010434-A1 PROCESS FOR PRODUCING BISPHENOL COMPOUND SULT2A1, SULT1A1, PLPBP CFTR 3179/4885SLC6A2 2843/4885SLC6A4 1187/4885

“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.