SCHEMBL939586

SCHEMBL939586

O=C(O)c1cccc(-c2nnn[nH]2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CD74 P04233 1/20 0.53
▸ MIF P14174 1/20 0.53
▸ KMO O15229 2/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ MAP2K4 P45985 2/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ MAPKAPK3 Q16644 1/20 0.49
▸ MAPK6 Q16659 1/20 0.49
▸ RXRA P19793 2/20 0.46
▸ RXRB P28702 2/20 0.46
▸ KEAP1 Q14145 1/20 0.44
▸ ADORA2B P29275 1/20 0.43
▸ DDT P30046 1/20 0.42
▸ CA12 O43570 1/20 0.42
▸ CA1 P00915 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
SCHEMBL30425732 1.00 CD74 (0.53) CD74MIFKMONPC1RAB9A
SCHEMBL27676654 0.89 ATM (0.41) CD74MIFKMONPC1RAB9A
SCHEMBL5168264 0.86 GRK6 (0.49) ALDH1A1
SCHEMBL3065165 0.86 PARP1 (0.46) MAP2K4MAPK1
SCHEMBL733156 0.84 DHODH (0.49) CD74MIFKMONPC1RAB9A
Hydrochloric Acid SCHEMBL12469361 0.84 MAP2K4 (0.45) MAP2K4MAPK1
SCHEMBL6175974 0.83 FFAR4 (0.38) CD74MIFKMONPC1RAB9A
SCHEMBL2513559 0.83 ALOX15 (0.36) CD74MIFNPC1RAB9ASMN1; SMN2
SCHEMBL1505455 0.82 GABRG2 (0.50) NPC1RAB9AALDH1A1HPGDCA12
SCHEMBL13542931 0.82 ACHE (0.38) CD74MIFNPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102503967-B One class single-substrate white rare earth compound and Synthesis and application thereof FUJIAN INSTITUTE OF RESEARCH ON THE STRUCTURE OF MATTER, CHINESE ACADEMY OF SCIENCES (CN) 2016-03-02 — — CN claimed
US-20230286970-A1 NOVEL OXADIAZOLE-BASED SELECTIVE HDAC6 INHIBITORS ITALFARMACO SPA (IT) 2023-09-14 — — US disclosed
EP-4192830-A1 2-(4-((5-(BENZO[B]THIOPHEN-3-YL)-1H-TETRAZOL-1-YL)METHYL)PHENYL)-5-(DIFLUOROMETHYL)-1,3,4-OXADIAZOLE DERIVATIVES AND SIMILAR COMPOUNDS AS SELECTIVE INHIBITORS OF HISTONE DEACETYLASE 6 (HDAC6) FOR USE IN TREATING E.G. PERIPHERAL NEUROPATHY Italfarmaco SpA (IT) 2023-06-14 — — EP disclosed
CN-116157398-A 2- (4- ((5- (benzo [ b ] thiophen-3-yl) -1H-tetrazol-1-yl) methyl) phenyl) -5- (difluoromethyl) -1,3, 4-oxadiazole derivatives and similar compounds as selective inhibitors of histone deacetylase 6 (HDAC 6) for the treatment of, for example, peripheral neuropathy 意大发马克股份公司 2023-05-23 — — CN disclosed
EP-3350177-A1 HETEROARYL COMPOUNDS AS IRAK INHIBITORS AND USES THEREOF Merck Patent GmbH (DE) 2018-07-25 — — EP disclosed
WO-2017049068-A1 HETEROARYL COMPOUNDS AS IRAK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2017-03-23 — — WO disclosed
US-20160361295-A1 FURO[3, 2-B] PYRR0L-3-ONES AS CATHESPIN S INHIBITORS AMURA THERAPEUTICS LTD (GB) 2016-12-15 — — US disclosed
CN-102503967-B One class single-substrate white rare earth compound and Synthesis and application thereof FUJIAN INSTITUTE OF RESEARCH ON THE STRUCTURE OF MATTER, CHINESE ACADEMY OF SCIENCES (CN) 2016-03-02 — — CN disclosed
CN-102503967-B One class single-substrate white rare earth compound and Synthesis and application thereof FUJIAN INSTITUTE OF RESEARCH ON THE STRUCTURE OF MATTER, CHINESE ACADEMY OF SCIENCES (CN) 2016-03-02 — — CN disclosed
US-20160015685-A1 FURO [3, 2-B] PYRR0L-3-0NES AS CATHESPIN S INHIBITORS AMURA THERAPEUTICS LTD (GB) 2016-01-21 — — US disclosed
US-5145765-A Containing a compound capable of releasing a development inhibitor by oxidation and a hydrazide compound FUJI PHOTO FILM CO., LTD. (JP) 1992-09-08 — — US disclosed
US-5132201-A Silver halide photographic material with redox releaser FUJI PHOTO FILM CO., LTD. (JP) 1992-07-21 — — US disclosed
US-5124231-A Mixture of hydrazine derivative, redox compound, and melting point lowering agent FUJI PHOTO FILM CO., LTD. (JP) 1992-06-23 — — US disclosed
US-5085971-A Redox system capable of releasing development inhibitor by oxidation and a hydrazine compound FUJI PHOTO FILM CO., LTD. (JP) 1992-02-04 — — US disclosed
EP-0442323-A2 Silver halide color reversal photographic material capable of providing interimage effect FUJI PHOTO FILM CO., LTD. (JP) 1991-08-21 — — EP disclosed
EP-0436027-A1 METHOD OF TREATING SILVER HALIDE PHOTOGRAPHIC MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 1991-07-10 — — EP disclosed
US-5006444-A Silver halide photographic material FUJI PHOTO FILM CO., LTD. (JP) 1991-04-09 — — US disclosed
EP-0420005-A1 high contrast silver halide photographic material FUJI PHOTO FILM CO., LTD. (JP) 1991-04-03 — — EP disclosed
EP-0398285-A2 Silver halide photographic materials FUJI PHOTO FILM CO., LTD. (JP) 1990-11-22 — — EP disclosed
EP-0395069-A2 Silver halide photographic materials FUJI PHOTO FILM CO., LTD. (JP) 1990-10-31 — — EP 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 (3 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-20160015685-A1 FURO [3, 2-B] PYRR0L-3-0NES AS CATHESPIN S INHIBITORS CTSS, CTSL, CTSK CD74 830/4885MIF 1358/4885KMO 495/4885
US-20160361295-A1 FURO[3, 2-B] PYRR0L-3-ONES AS CATHESPIN S INHIBITORS CTSS, CTSL, CTSK CD74 1040/4885MIF 984/4885KMO 546/4885
US-20230286970-A1 NOVEL OXADIAZOLE-BASED SELECTIVE HDAC6 INHIBITORS HDAC6, HDAC1, HDAC3 CD74 2248/4885MIF 2725/4885KMO 1975/4885

“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.

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