SCHEMBL4083992

SCHEMBL4083992

Nc1cccc2cc(Cl)ccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.54
ALDH1A1 P00352 6/20 0.54
TSHR P16473 5/20 0.54
HPGD P15428 4/20 0.54
HSD17B10 Q99714 3/20 0.54
KEAP1 Q14145 1/20 0.54
CYP2A6 P11509 1/20 0.48
NR4A2 P43354 4/20 0.46
SOS2 Q07890 1/20 0.46
TDP1 Q9NUW8 2/20 0.44
ALOX15 P16050 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
TP53 P04637 1/20 0.43
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL31179229 1.00 CYP3A4 (0.54) CYP3A4ALDH1A1TSHRHPGDHSD17B10
SCHEMBL4088198 0.83 ALDH1A1 (0.54) CYP3A4ALDH1A1TSHRHPGDHSD17B10
Hydrochloric Acid SCHEMBL31178856 0.81 ALDH1A1 (0.52) CYP3A4ALDH1A1TSHRHPGDHSD17B10
SCHEMBL29498391 0.77 PLAU (0.63) CYP3A4ALDH1A1TSHRHPGDHSD17B10
SCHEMBL731002 0.77 PLAU (0.63) CYP3A4ALDH1A1TSHRHPGDHSD17B10
SCHEMBL29404930 0.77 PLAU (0.63) CYP3A4ALDH1A1TSHRHPGDHSD17B10
SCHEMBL30366437 0.77 CYP1A2 (0.58) CYP3A4ALDH1A1TSHRCYP2A6NR4A2
SCHEMBL30366566 0.77 CYP1A2 (0.58) CYP3A4ALDH1A1TSHRCYP2A6NR4A2
SCHEMBL1780245 0.77 CYP1A2 (0.58) CYP3A4ALDH1A1TSHRCYP2A6NR4A2
SCHEMBL29351158 0.76 ALDH1A1 (0.62) CYP3A4ALDH1A1TSHRHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250188073-A1 TRICYCLIC COMPOUNDS AS INHIBITORS OF KRAS INCYTE CORP (US) 2025-06-12 US disclosed
EP-4558479-A1 NOVEL NAPHTHYL AND ISOQUINOLINE SULFONAMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2025-05-28 EP disclosed
EP-4548918-A2 TRICYCLIC COMPOUNDS AS INHIBITORS OF KRAS Incyte Corporation (US) 2025-05-07 EP disclosed
WO-2024017858-A1 NOVEL NAPHTHYL AND ISOQUINOLINE SULFONAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2024-01-25 WO disclosed
EP-4087843-A1 TRICYCLIC COMPOUNDS AS INHIBITORS OF KRAS Incyte Corporation (US) 2022-11-16 EP disclosed
US-10793584-B2 Naphthobischalcogenadiazole derivative and production method therefor OSAKA UNIVERSITY (JP) 2020-10-06 US disclosed
US-20190337966-A1 NAPHTHOBISCHALCOGENADIAZOLE DERIVATIVE AND PRODUCTION METHOD THEREFOR OSAKA UNIVERSITY (JP) 2019-11-07 US disclosed
US-10398679-B2 Treatment method utilizing pyrrolidine-2, 5-dione derivatives as IDO1 inhibitors ITEOS THERAPEUTICS (BE) 2019-09-03 US disclosed
US-10398679-B2 Treatment method utilizing pyrrolidine-2, 5-dione derivatives as IDO1 inhibitors ITEOS THERAPEUTICS (BE) 2019-09-03 US disclosed
CN-106536480-B Pyrrolidine-2, 5-dione derivatives, pharmaceutical compositions and methods for use as IDO1 inhibitors 艾特奥斯治疗公司 2019-09-03 CN disclosed
US-20170035731-A1 PYRROLIDINE-2, 5-DIONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE AS IDO1 INHIBITORS ITEOS THERAPEUTICS (BE) 2017-02-09 US disclosed
US-20170035731-A1 PYRROLIDINE-2, 5-DIONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE AS IDO1 INHIBITORS ITEOS THERAPEUTICS (BE) 2017-02-09 US disclosed
US-20150329525-A1 PYRROLIDINE-2, 5-DIONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE AS IDO1 INHIBITORS ITEOS THERAPEUTICS (BE) 2015-11-19 US disclosed
WO-2015173764-A1 PYRROLIDINE-2,5-DIONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE AS IDO1 INHIBITORS ITEOS THERAPEUTICS (BE) 2015-11-19 WO disclosed
CN-1863784-B 2-naphthylimino-1,3-thiazine derivative SHIONOGI & CO 2010-11-17 CN disclosed
US-7482339-B2 2-Naphthylimino-1,3-thiazine derivative SHIONOGI AND CO., LTD. (JP) 2009-01-27 US disclosed
US-20060281738-A1 2-Naphthylimino-1,3-thiazine derivative SHIONOGI AND CO., LTD. (JP) 2006-12-14 US disclosed
CN-1863784-A 2-naphthylimino-1,3-thiazine derivative SHIONOGI & CO (JP) 2006-11-15 CN disclosed
EP-1659117-A1 2-NAPHTHYLIMINO-1,3-THIAZINE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2006-05-24 EP disclosed
WO-2005123089-A2 MULTICYCLIC SULFONAMIDE COMPOUNDS AS INHIBITORS OF HISTONE DEACETYLASE FOR THE TREATMENT OF DISEASE KALYPSYS, INC. (US) 2005-12-29 WO 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 (7 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-10793584-B2 Naphthobischalcogenadiazole derivative and production method therefor CYP24A1, CYP26B1, CYP21A2 CYP3A4 389/4885ALDH1A1 600/4885TSHR 1397/4885
US-20190337966-A1 NAPHTHOBISCHALCOGENADIAZOLE DERIVATIVE AND PRODUCTION METHOD THEREFOR CYP24A1, CYP26B1, CYP21A2 CYP3A4 389/4885ALDH1A1 600/4885TSHR 1397/4885
US-20060281738-A1 2-Naphthylimino-1,3-thiazine derivative NPM1, OXTR, CYP2S1 CYP3A4 95/4885ALDH1A1 1571/4885TSHR 440/4885
US-20250188073-A1 TRICYCLIC COMPOUNDS AS INHIBITORS OF KRAS KRAS, NRAS, HRAS CYP3A4 3923/4885ALDH1A1 2204/4885TSHR 4621/4885
US-20170035731-A1 PYRROLIDINE-2, 5-DIONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE AS IDO1 INHIBITORS IDO1, IDO2, ARG1 CYP3A4 905/4885ALDH1A1 357/4885TSHR 4401/4885
US-20150329525-A1 PYRROLIDINE-2, 5-DIONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE AS IDO1 INHIBITORS IDO1, IDO2, ARG1 CYP3A4 437/4885ALDH1A1 212/4885TSHR 4368/4885
US-10398679-B2 Treatment method utilizing pyrrolidine-2, 5-dione derivatives as IDO1 inhibitors IDO1, IDO2, NAT1 CYP3A4 910/4885ALDH1A1 241/4885TSHR 4356/4885

“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.