SCHEMBL971517

SCHEMBL971517

O=Cc1ccc2oc(=O)ccc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 6/20 0.56
CA9 Q16790 6/20 0.56
ALDH1A1 P00352 3/20 0.56
MCL1 Q07820 3/20 0.56
CYP2A6 P11509 2/20 0.56
LMNA P02545 3/20 0.53
CYP1A2 P05177 2/20 0.53
CYP3A4 P08684 2/20 0.53
MAPT P10636 2/20 0.53
HPGD P15428 2/20 0.53
ALOX15 P16050 2/20 0.53
HIF1A Q16665 2/20 0.53
HSD17B10 Q99714 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
MEN1 O00255 1/20 0.53
GMNN O75496 1/20 0.53
TP53 P04637 1/20 0.53
CYP2D6 P10635 1/20 0.53
TSHR P16473 1/20 0.53
MAPK1 P28482 1/20 0.53

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
SCHEMBL29956607 1.00 CA12 (0.56) CA12CA9ALDH1A1MCL1CYP2A6
SCHEMBL29955511 0.86 CA12 (0.55) CA12CA9ALDH1A1MCL1CYP2A6
SCHEMBL1163297 0.86 CA12 (0.55) CA12CA9ALDH1A1MCL1CYP2A6
SCHEMBL3363446 0.83 CA12 (0.55) CA12CA9ALDH1A1MCL1CYP2A6
SCHEMBL18199882 0.83 CA12 (0.55) CA12CA9ALDH1A1MCL1CYP2A6
SCHEMBL30425563 0.79 ACHE (0.60) CA12CA9ALDH1A1MCL1CYP2A6
SCHEMBL27757975 0.79 ACHE (0.60) CA12CA9ALDH1A1MCL1CYP2A6
SCHEMBL11971153 0.75 CA9 (0.56) CA12CA9ALDH1A1MCL1CYP2A6
SCHEMBL11971156 0.75 CA9 (0.56) CA12CA9ALDH1A1MCL1CYP2A6
SCHEMBL5144216 0.74 CYP2A6 (0.65) CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117645708-A Photo-thermal repair polyurea with adjustable performance based on multiple dynamic bonds and preparation method thereof 浙江万亿星新材料科技有限公司 2024-03-05 CN claimed
CN-115557878-A Indocyanine derivatives, and preparation and application thereof 广西大学 2023-01-03 CN claimed
US-9127092-B2 Method for producing polydienes and polydiene copolymers with reduced cold flow BRIDGESTONE CORPORATION (JP) 2015-09-08 US claimed
US-20140187725-A1 METHOD FOR PRODUCING POLYDIENES AND POLYDIENE COPOLYMERS WITH REDUCED COLD FLOW BRIDGESTONE CORPORATION (JP) 2014-07-03 US claimed
US-12570654-B2 Nanoluc suicide substrates PROMEGA CORPORATION (US) 2026-03-10 US disclosed
CN-119701896-A Method for extracting coumarin from lavender 李雪 2025-03-28 CN disclosed
CN-117645708-A Photo-thermal repair polyurea with adjustable performance based on multiple dynamic bonds and preparation method thereof 浙江万亿星新材料科技有限公司 2024-03-05 CN disclosed
CN-117645708-A Photo-thermal repair polyurea with adjustable performance based on multiple dynamic bonds and preparation method thereof 浙江万亿星新材料科技有限公司 2024-03-05 CN disclosed
US-20230382908-A1 NANOLUC SUICIDE SUBSTRATES PROMEGA CORPORATION 2023-11-30 US disclosed
US-11655247-B2 Nanoluc suicide substrates PROMEGA CORPORATION (US) 2023-05-23 US disclosed
CN-115557878-A Indocyanine derivatives, and preparation and application thereof 广西大学 2023-01-03 CN disclosed
EP-3788048-A1 COELENTERAZINE COMPOUNDS AS NANOLUC SUICIDE SUBSTRATES Promega Corporation (US) 2021-03-10 EP disclosed
US-7026491-B2 Coumarin derivatives useful as TNFα inhibitors CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2006-04-11 US disclosed
US-20060020138-A1 Coumarin derivatives useful as TNFalpha inhibitors CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2006-01-26 US disclosed
WO-2005054179-A2 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF LEO PHARMA A/S (DK) 2005-06-16 WO disclosed
EP-1531820-A1 ANABASEINE DERIVATIVES USEFUL IN THE TREATMENT OF NEURODEGENERATIVE DISEASES Memory Pharmaceuticals Corporation (US) 2005-05-25 EP disclosed
US-20050014705-A1 Coumarin derivatives useful as tnf alpha inhibitors CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2005-01-20 US disclosed
US-20040229868-A1 Heterocyclic compounds, methods for the preparation thereof, and uses thereof MEMORY PHARMACEUTICALS CORP. 2004-11-18 US disclosed
WO-2004019943-A1 ANABASEINE DERIVATIVES USEFUL IN THE TREATMENT OF NEURODEGENERATIVE DISEASES MEMORY PHARMACEUTICALS CORPORATION (US) 2004-03-11 WO disclosed
WO-2002008217-A2 COUMARIN DERIVATIVES USEFUL AS TNFα INHIBITORS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-01-31 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 (6 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-20230382908-A1 NANOLUC SUICIDE SUBSTRATES XIAP, NLN, BAD CA12 4710/4885CA9 4720/4885ALDH1A1 2032/4885
US-20040229868-A1 Heterocyclic compounds, methods for the preparation thereof, and uses thereof CHRNA1, CHRNA4, CHRNA3 CA12 2418/4885CA9 2549/4885ALDH1A1 370/4885
US-20050014705-A1 Coumarin derivatives useful as tnf alpha inhibitors TNF, NFKBIA, TNFRSF1A CA12 3775/4885CA9 3821/4885ALDH1A1 1457/4885
US-11655247-B2 Nanoluc suicide substrates XIAP, NLN, BAD CA12 4710/4885CA9 4720/4885ALDH1A1 2032/4885
US-12570654-B2 Nanoluc suicide substrates NR3C1, LUC7L2, L3MBTL1 CA12 3938/4885CA9 3334/4885ALDH1A1 1718/4885
US-20060020138-A1 Coumarin derivatives useful as TNFalpha inhibitors TNF, NFKBIA, TNFRSF1A CA12 3397/4885CA9 3930/4885ALDH1A1 1823/4885

“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.