SCHEMBL2335763

SCHEMBL2335763

CC(C)c1ccc(N=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2C9 P11712 2/20 0.47
▸ ALDH1A1 P00352 4/20 0.46
▸ HSD17B10 Q99714 3/20 0.46
▸ TYR P14679 2/20 0.46
▸ HIF1A Q16665 2/20 0.46
▸ TSHR P16473 2/20 0.46
▸ TP53 P04637 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ GRIN2D O15399 3/20 0.42
▸ GRIN3B O60391 3/20 0.42
▸ GRIN1 Q05586 3/20 0.42
▸ GRIN2A Q12879 3/20 0.42
▸ GRIN2B Q13224 3/20 0.42
▸ GRIN2C Q14957 3/20 0.42
▸ GRIN3A Q8TCU5 3/20 0.42
▸ SIGMAR1 Q99720 1/20 0.42
▸ NOS3 P29474 2/20 0.41
▸ NOS1 P29475 2/20 0.41
▸ NOS2 P35228 2/20 0.41

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
SCHEMBL9218739 0.87 ALDH1A1 (0.59) CYP2C9ALDH1A1HSD17B10TYRHIF1A
SCHEMBL22593867 0.84 ALDH1A1 (0.46) CYP2C9ALDH1A1HSD17B10TYRHIF1A
SCHEMBL12312062 0.80 ADRB2 (0.50) CYP2C9ALDH1A1HSD17B10HIF1ATSHR
SCHEMBL14944003 0.80 NOS3 (0.55) CYP2C9ALDH1A1HSD17B10HIF1ATSHR
SCHEMBL28851656 0.80 ALDH1A1 (0.48) CYP2C9ALDH1A1HSD17B10HIF1ATSHR
SCHEMBL16906255 0.80 ALDH1A1 (0.43) CYP2C9ALDH1A1HSD17B10HIF1ATSHR
SCHEMBL11060219 0.80 ADRB2 (0.50) CYP2C9ALDH1A1HSD17B10HIF1ATSHR
SCHEMBL14175092 0.80 ADRB2 (0.50) CYP2C9ALDH1A1HSD17B10HIF1ATSHR
SCHEMBL28196011 0.78 ALDH1A1 (0.46) CYP2C9ALDH1A1HSD17B10HIF1ATSHR
SCHEMBL20251135 0.78 RAB9A (0.50) CYP2C9ALDH1A1TYRMAPK1SMN1; 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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118271243-A Benzazepine compound and preparation method thereof 浙大城市学院 2024-07-02 — — CN disclosed
US-11773052-B2 Enamine compound and use thereof JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2023-10-03 — — US disclosed
EP-3939968-A1 NOVEL COMPOUND HAVING ANTICANCER ACTIVITY, AND METHOD FOR PRODUCING SAME Medicinal Bioconvergence Research Center (KR) 2022-01-19 — — EP disclosed
EP-3904424-A1 POLY(ARYLENE ETHER KETONE) RESIN, PRODUCTION METHOD FOR SAME, AND MOLDED ARTICLE DIC Corporation (JP) 2021-11-03 — — EP disclosed
EP-3353152-B1 METHOD NORSK MEDISINSK SYKLOTRONSENTER AS (NO) 2021-09-15 — — EP disclosed
EP-2094210-B2 MEDICAL FABRIC HARTMANN PAUL AG (DE) 2021-09-08 — — EP disclosed
US-20210252174-A1 METHOD NORSK MEDISINSK SYKLOTRONSENTER AS (NO) 2021-08-19 — — US disclosed
WO-2021074080-A1 KIT COMPOSED OF A TWO-PART TISSUE ADHESIVE AND A TEMPORARY PROTECTIVE LINER THEREFOR, AND USE THEREOF ADHESYS MEDICAL GMBH (DE) 2021-04-22 — — WO disclosed
EP-3786207-A1 ISOCYANATE FUNCTIONAL PRE-POLYMER FOR A BIODEGRADABLE TISSUE ADHESIVE Adhesys Medical GmbH (DE) 2021-03-03 — — EP disclosed
EP-3385294-B1 ISOCYANATE FUNCTIONAL PRE-POLYMER FOR A BIODEGRADABLE TISSUE ADHESIVE ADHESYS MEDICAL GMBH (DE) 2020-11-11 — — EP disclosed
US-20130023556-A1 AUTOTAXIN INHIBITORS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-01-24 — — US disclosed
EP-2534187-A1 ACTIVE SUBSTANCE-RELEASING WOUND DRESSING Bayer Intellectual Property GmbH (DE) 2012-12-19 — — EP disclosed
WO-2011098444-A1 ACTIVE SUBSTANCE-RELEASING WOUND DRESSING BAYER MATERIALSCIENCE AG (DE) 2011-08-18 — — WO disclosed
EP-2094210-A2 MEDICAL FABRIC Paul Hartmann AG (DE) 2009-09-02 — — EP disclosed
EP-1962802-A1 MEDICINAL COMPOSITION WITH ACTIVE INGREDIENTS AND WOUND CONTACT LAYER WITH A COMPOSITION Paul Hartmann AG (DE) 2008-09-03 — — EP disclosed
WO-2008080532-A2 MEDICAL FABRIC PAUL HARTMANN AG (DE) 2008-07-10 — — WO disclosed
US-20080161580-A1 PROTECTED 3,5-DIHYDROXY-2,2-DIMETHYL-VALEROAMIDES FOR THE SYNTHESIS OF EPOTHILONES AND DERIVATIVES AND PROCESS FOR THE PRODUCTION AND THE USE WESTERMANN JURGEN 2008-07-03 — — US disclosed
US-20080076924-A1 Piperazines as P2X7 antagonists ABBOTT LABORATORIES 2008-03-27 — — US disclosed
US-20080076924-A1 Piperazines as P2X7 antagonists ABBOTT LABORATORIES 2008-03-27 — — US disclosed
WO-2007068492-A1 MEDICINAL COMPOSITION WITH ACTIVE INGREDIENTS AND WOUND CONTACT LAYER WITH A COMPOSITION PAUL HARTMANN AG (DE) 2007-06-21 — — 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 (5 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-11773052-B2 Enamine compound and use thereof ENY2, AHR, PAH CYP2C9 98/4885ALDH1A1 974/4885HSD17B10 348/4885
US-20080161580-A1 PROTECTED 3,5-DIHYDROXY-2,2-DIMETHYL-VALEROAMIDES FOR THE SYNTHESIS OF EPOTHILONES AND DERIVATIVES AND PROCESS FOR THE PRODUCTION AND THE USE DHPS, VARS1, CYP51A1 CYP2C9 673/4885ALDH1A1 1091/4885HSD17B10 20/4885
US-20210252174-A1 METHOD MPI, DUT, NT5E CYP2C9 2602/4885ALDH1A1 1340/4885HSD17B10 1738/4885
US-20130023556-A1 AUTOTAXIN INHIBITORS ENPP2, PLA2G12A, LPCAT1 CYP2C9 4824/4885ALDH1A1 4088/4885HSD17B10 2252/4885
US-20080076924-A1 Piperazines as P2X7 antagonists P2RX7, P2RX1, P2RX2 CYP2C9 841/4885ALDH1A1 852/4885HSD17B10 4228/4885

“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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