SCHEMBL2031602

SCHEMBL2031602

O=C(O)c1ccc2sc(S)nc2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.68
RAB9A P51151 6/20 0.68
SMN1; SMN2 Q16637 5/20 0.68
KDM4E B2RXH2 6/20 0.46
NFKB1 P19838 2/20 0.46
NFKB2 Q00653 2/20 0.46
RELA Q04206 2/20 0.46
LMNA P02545 1/20 0.46
TDP1 Q9NUW8 4/20 0.46
HSD17B10 Q99714 1/20 0.45
HKDC1 Q2TB90 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HDAC6 Q9UBN7 7/20 0.43
ALDH1A1 P00352 3/20 0.43
GAA P10253 3/20 0.43
HPGD P15428 3/20 0.43
POLB P06746 2/20 0.43
MAPT P10636 2/20 0.43
MITF O75030 1/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL6267261 0.86 SMN1; SMN2 (0.62) NPC1RAB9ASMN1; SMN2KDM4ENFKB1
SCHEMBL9306708 0.85 NPC1 (0.49) NPC1RAB9ASMN1; SMN2KDM4ENFKB1
SCHEMBL9734141 0.81 THRB (0.56) NPC1RAB9ASMN1; SMN2TDP1HDAC6
SCHEMBL9305296 0.81 PIK3CA (0.50) NPC1RAB9ASMN1; SMN2KDM4ELMNA
SCHEMBL25252536 0.81 NPC1 (0.70) NPC1RAB9ASMN1; SMN2KDM4ENFKB1
SCHEMBL30063475 0.81 NPC1 (0.70) NPC1RAB9ASMN1; SMN2KDM4ENFKB1
SCHEMBL1105986 0.81 NPC1 (1.00) NPC1RAB9ASMN1; SMN2KDM4ENFKB1
SCHEMBL9307022 0.79 RAB9A (0.57) NPC1RAB9ASMN1; SMN2KDM4ENFKB1
SCHEMBL11147962 0.79 NPC1 (0.68) NPC1RAB9ASMN1; SMN2KDM4ENFKB1
SCHEMBL9307890 0.79 NPC1 (0.68) NPC1RAB9ASMN1; SMN2KDM4ENFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5126229-A No background contamination FUJI PHOTO FILM CO., LTD. (JP) 1992-06-30 US claimed
US-4021248-A SILVER HALIDE FUJI PHOTO FILM CO., LTD. (JA) 1977-05-03 US claimed
JP-4170538-A None JP disclosed
CN-121471212-A High-temperature high-acid stable heavy metal chelating agent and preparation method and application thereof 成都汇锦水务发展有限公司 2026-02-06 CN disclosed
US-20240132705-A1 RUBBER COMPOSITION AND CROSSLINKED RUBBER MOLDED PRODUCT SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2024-04-25 US disclosed
CN-107743483-B NADPH oxidase 4 inhibitors 埃科特莱茵药品有限公司 2022-01-28 CN disclosed
US-20210395238-A1 NADPH OXIDASE 4 INHIBITORS ACTELTION PHARMACEUTICALS LTD (CH) 2021-12-23 US disclosed
US-11136317-B2 NADPH oxidase 4 inhibitors ACTELION PHARMACEUTICALS LTD (CH) 2021-10-05 US disclosed
EP-3310767-B1 2,5-DISUBSTITUTED BENZOXAZOLE AND BENZOTHIAZOLE COMPOUNDS AS NADPH OXIDASE 4 INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2020-07-22 EP disclosed
US-20200165235-A1 NADPH OXIDASE 4 INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2020-05-28 US disclosed
US-10584118-B2 NADPH oxidase 4 inhibitors ACTELION PHARMACEUTICALS LTD (CH) 2020-03-10 US disclosed
EP-0161220-A2 Process for the preparation of beta-(benzothiazolylthio) and beta (benzimidazolylthio)carboxylic-acid derivatives CIBA-GEIGY AG (CH) 1985-11-13 EP disclosed
EP-0137426-A2 2-Mercaptothiazole derivatives, process for their preparation and utilization of 2-mercaptothiazole derivatives in pharmaceutical compounds BAYER AG (DE) 1985-04-17 EP disclosed
EP-0129506-A2 Heterocyclically substituted thio(cyclo)alkane polycarboxylic acids CIBA-GEIGY AG (CH) 1984-12-27 EP disclosed
EP-0126030-A2 Process for the preparation of beta-(benzothiazolylthio) and beta-(benzimidazolylthio) carboxylic acids CIBA-GEIGY AG (CH) 1984-11-21 EP disclosed
US-4343660-A PETROLEUM SULFONATE AND COMPLEXING AGENT, FOR COPPER CABLES PETROLITE CORPORATION (US) 1982-08-10 US disclosed
US-4322214-A USING A SULFUR OR SULFURIZED VAT DYE IN AN ALKALINE BATH CONTAINING A MERCAPTO COMPOUND AND A SULFITE SALT; LEVELING ASAHI CHEMICAL COMPANY LIMITED (JP) 1982-03-30 US disclosed
US-4138346-A ETHOXYLATED PHOSPHATE ESTER WITH A MERCAPTOTHIAZOLE, A DITHIOBIS-THIAZOLE, A SULFIDE, A DISULFIDE OR A SULFONE BASF WYANDOTTE CORPORATION (US) 1979-02-06 US disclosed
US-4021248-A SILVER HALIDE FUJI PHOTO FILM CO., LTD. (JA) 1977-05-03 US disclosed
US-3933658-A PHOSPHATE ESTER AND SULFUR COMPOUND GAF CORPORATION (US) 1976-01-20 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 (4 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-10584118-B2 NADPH oxidase 4 inhibitors NOX4, NOX1, CYBB NPC1 3120/4885RAB9A 2128/4885SMN1; SMN2 3582/4885
US-20200165235-A1 NADPH OXIDASE 4 INHIBITORS NOX4, NOX1, CYBB NPC1 3120/4885RAB9A 2128/4885SMN1; SMN2 3582/4885
US-11136317-B2 NADPH oxidase 4 inhibitors NOX4, NOX1, CYBB NPC1 3120/4885RAB9A 2128/4885SMN1; SMN2 3582/4885
US-20210395238-A1 NADPH OXIDASE 4 INHIBITORS NOX4, NOX1, CYBB NPC1 3120/4885RAB9A 2128/4885SMN1; SMN2 3582/4885

“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.