SCHEMBL253431

SCHEMBL253431

C=CC(S)c1ccccn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.45
SLC6A4 P31645 2/20 0.45
SLC6A3 Q01959 1/20 0.45
KCNA5 P22460 5/20 0.40
KCNE1 P15382 2/20 0.40
TSHR P16473 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ATM Q13315 1/20 0.38
KCNH2 Q12809 1/20 0.38
KDM4E B2RXH2 3/20 0.37
CYP2D6 P10635 1/20 0.36
CYP1A2 P05177 3/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
CCR1 P32246 1/20 0.36
CCR5 P51681 1/20 0.36

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
SCHEMBL11800360 0.78 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3KCNA5KCNE1
SCHEMBL6160196 0.78 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3KCNA5KCNE1
SCHEMBL27539508 0.76
SCHEMBL29724050 0.75 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3KCNA5KCNE1
SCHEMBL11034374 0.75 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3KCNA5KCNE1
SCHEMBL4954290 0.75 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3KCNA5KCNE1
SCHEMBL1385556 0.75 SLC6A3 (0.45) SLC6A2SLC6A4SLC6A3KCNA5KCNE1
SCHEMBL21742323 0.75 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3KCNA5KCNE1
SCHEMBL4759333 0.75 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3KCNA5KCNE1
SCHEMBL1525815 0.75 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3KCNA5KCNE1

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 150 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240109831-A1 PROCESS FOR PREPARING BISPHENOL A (BPA) IN THE PRESENCE OF BENZENE COVESTRO DEUTSCHLAND AG (DE) 2024-04-04 US claimed
US-20240076256-A1 PROCESS FOR PREPARING BISPHENOL A (BPA) IN THE PRESENCE OF ALPHA-METHYLSTYRENE COVESTRO DEUTSCHLAND AG (DE) 2024-03-07 US claimed
US-20240001352-A1 CATALYST SYSTEM AND PROCESS FOR PRODUCING BISPHENOL-A BADGER LICENSING LLC 2024-01-04 US claimed
EP-4298083-A1 PROCESS FOR PREPARING BISPHENOL A (BPA) IN THE PRESENCE OF ACETOPHENONE Covestro Deutschland AG (DE) 2024-01-03 EP claimed
EP-4298080-A1 PROCESS FOR PREPARING BISPHENOL A (BPA) IN THE PRESENCE OF ALPHA-METHYLSTYRENE Covestro Deutschland AG (DE) 2024-01-03 EP claimed
EP-4298079-A1 PROCESS FOR PREPARING BISPHENOL A (BPA) IN THE PRESENCE OF BENZENE Covestro Deutschland AG (DE) 2024-01-03 EP claimed
EP-4298084-A1 PROCESS FOR PREPARING BISPHENOL A (BPA) IN THE PRESENCE OF CUMENE Covestro Deutschland AG (DE) 2024-01-03 EP claimed
EP-3847150-B1 PROCESS FOR PRODUCING BISPHENOL-A BADGER LICENSING LLC (US) 2023-11-22 EP claimed
CN-116917261-A Process for the preparation of bisphenol A (BPA) in the presence of benzene 科思创德国股份有限公司 2023-10-20 CN claimed
CN-116897145-A Process for the preparation of bisphenol A (BPA) in the presence of alpha-methylstyrene 科思创德国股份有限公司 2023-10-17 CN claimed
EP-1686116-A1 PROCESS FOR PRODUCTION OF PYRIDYLETHYLTHIO COMPOUNDS, MODIFIED ION EXCHANGERS, PROCESS FOR PRODUCTION THEREOF, AND PROCESS FOR PRODUCTION OF BISPHENOLS Mitsubishi Chemical Corporation (JP) 2006-08-02 EP claimed
CN-1249001-C Process for producing bisphenol A IDEMITSU PETROCHEMICAL CO (JP) 2006-04-05 CN claimed
US-20060041145-A1 Process for producing pyridylethylthio compound, modified ion exchanger and process for producing the same, and process for producing bisphenol compound MITSUBISHI CHEMICAL CORPORATION (JP) 2006-02-23 US claimed
US-6946581-B2 Bisphenol compound composition having excellent thermal stability MITSUBISHI CHEMICAL CORPORATION (JP) 2005-09-20 US claimed
US-20040192975-A1 Process for producing bisphenol A IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2004-09-30 US claimed
US-6740784-B2 CONDENSATION REACTION BETWEEN PHENOL AND ACETONE USING AN ACID TYPE ION EXCHANGE RESIN MODIFIED IN PART WITH A SULFUR-CONTAINING AMINE COMPOUND; SUPPRESSED DETERIORATION OF CATALYST DUE TO METHANOL IMPURITY IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2004-05-25 US claimed
US-20030234381-A1 Bisphenol compound composition having excellent thermal stability MITSUBISHI CHEMICAL CORPORATION (JP) 2003-12-25 US claimed
EP-1371623-A1 PROCESS FOR PRODUCING BISPHENOL A IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2003-12-17 EP claimed
CN-1457333-A Process for producing bisphenol A IDEMITSU PETROCHEMICAL CO (JP) 2003-11-19 CN claimed
US-20030153792-A1 Process for producing bisphenol a IDEMITSU KOSAN CO. LTD. (JP) 2003-08-14 US 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 (2 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-20060041145-A1 Process for producing pyridylethylthio compound, modified ion exchanger and process for producing the same, and process for producing bisphenol compound PAH, SLC19A2, PLPBP SLC6A2 153/4885SLC6A4 18/4885SLC6A3 157/4885
US-20240001352-A1 CATALYST SYSTEM AND PROCESS FOR PRODUCING BISPHENOL-A ARSA, CREBBP, PSPH SLC6A2 3516/4885SLC6A4 3101/4885SLC6A3 2800/4885

“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.