SCHEMBL985214

SCHEMBL985214

O=C(O)c1c[nH]c2ncccc12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 1/20 0.71
CAMKK2 Q96RR4 3/20 0.60
ADORA2A P29274 1/20 0.57
CNR2 P34972 1/20 0.56
AXL P30530 1/20 0.55
KMT2A Q03164 1/20 0.54
GPR84 Q9NQS5 1/20 0.53
CCNE1 P24864 3/20 0.52
CDK2 P24941 3/20 0.52
CAMKK1 Q8N5S9 1/20 0.52
MET P08581 2/20 0.51
KDM4E B2RXH2 2/20 0.50
LRRK2 Q5S007 1/20 0.50
MTNR1A P48039 1/20 0.50
KIF20A O95235 1/20 0.50
CLK1 P49759 1/20 0.50
CLK2 P49760 1/20 0.50
CDK5 Q00535 1/20 0.50
DYRK1A Q13627 1/20 0.50
CDK5R1 Q15078 1/20 0.50

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
SCHEMBL29468201 1.00 MAP2K1 (0.71) MAP2K1CAMKK2ADORA2ACNR2AXL
Hydrochloric Acid SCHEMBL3608101 0.98 MAP2K1 (0.69) MAP2K1CAMKK2ADORA2ACNR2AXL
Methoxymethane SCHEMBL28146835 0.93 MAP2K1 (0.77) MAP2K1CAMKK2ADORA2ACNR2AXL
SCHEMBL2114977 0.90 ADORA2A (0.67) MAP2K1CAMKK2ADORA2ACNR2AXL
SCHEMBL27708260 0.89 MAP2K1 (0.71) MAP2K1CAMKK2ADORA2ACNR2AXL
Hydrochloric Acid SCHEMBL10655021 0.89 ADORA2A (0.65) MAP2K1CAMKK2ADORA2ACNR2AXL
SCHEMBL1474975 0.88 MAP2K1 (0.65) MAP2K1CAMKK2ADORA2ACNR2AXL
Hydrochloric Acid SCHEMBL3595977 0.86 MAP2K1 (0.63) MAP2K1CAMKK2ADORA2ACNR2AXL
SCHEMBL12647233 0.86 MAP2K1 (0.67) MAP2K1CAMKK2ADORA2ACNR2AXL
SCHEMBL2991525 0.86 MAP2K1 (0.71) MAP2K1CAMKK2ADORA2ACNR2AXL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117343058-A Substituted 7-azaindole-3-carboxylic acid Mcl-1 protein inhibitor and preparation method and application thereof 湖南科技大学 2024-01-05 CN claimed
CN-114054099-B Fe (Fe) 3 O 4 @SiO 2 -2N-CoCl 2 Catalyst, preparation method and application thereof 万华化学集团股份有限公司 2023-07-11 CN claimed
CN-115537083-A Preparation method and application of high-performance low-VOC (volatile organic compound) composite resin for chrome-free nonmetal tanning 兴业皮革科技股份有限公司 2022-12-30 CN claimed
CN-115521693-A Preparation method of UV-resistant flame-retardant waterproof polyurethane resin and high-grade calf leather 兴业皮革科技股份有限公司 2022-12-27 CN claimed
CN-114054099-A Fe3O4@SiO2-2N-CoCl2Catalyst, preparation method and application thereof 万华化学集团股份有限公司 2022-02-18 CN claimed
CN-110041328-A A kind of preparation method of fluoro- 1H- pyrrolo- [2,3-b] pyridine-3-carboxylic acid of 5- 南京合巨药业有限公司 2019-07-23 CN claimed
CN-107903261-A A kind of synthetic method of 7 azaindole, 3 carboxylic acid 东莞市联洲知识产权运营管理有限公司 2018-04-13 CN claimed
CN-105753866-A 4-halo-7-azaindole and preparation method thereof 叶芳 2016-07-13 CN claimed
CN-105218546-A The synthesis technique of 1H-pyrrolo-[2,3-B] pyridine-3-carboxylic acid methyl esters SHANGHAI TITAN TECHNOLOGY CO LTD 2016-01-06 CN claimed
EP-1888579-B1 NOVEL FLUORENE DERIVATIVES, COMPOSITION CONTAINING SAID DERIVATIVES AND THE USE THEREOF AVENTIS PHARMA SA (FR) 2011-08-03 EP claimed
US-7674795-B2 Fluorene derivatives, composition containing said derivatives and the use thereof AVENTIS PHARMA SA (FR) 2010-03-09 US claimed
US-20080153837-A1 Novel Fluorene Derivatives, Composition Containing Said Derivatives and the Use Thereof AVENTIS PHARMA S.A. (FR) 2008-06-26 US claimed
CN-1247576-C Novel 7-azaindoles, their use as inhibitors of phosphodiesterase 4 and process for their preparation ELBION AG (DE) 2006-03-29 CN claimed
EP-1330455-B1 NOVEL 7-AZAINDOLES, USE THEREOF AS PHOSPHODIESTERASE 4 INHIBITORS AND METHOD FOR PRODUCING THE SAME ELBION AG (DE) 2005-08-03 EP claimed
US-20040106641-A1 Novel 7-azaindoles, use thereof as phosphodiesterase 4 inhibitors and method for producing the same BIOTIE THERAPIES GMBH (DE) 2004-06-03 US claimed
CN-1484644-A Novel 7-azaindoles, their use as inhibitors of phosphodiesterase 4 and process for their preparation �����ɷ� 2004-03-24 CN claimed
EP-1149098-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF 7-AZAINDOLYL-3-CARBOXYLIC ACID Dompé S.P.A. (IT) 2001-10-31 EP claimed
WO-2000029411-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF 7-AZAINDOLYL-3-CARBOXYLIC ACID DOMPE' SPA (IT) 2000-05-25 WO claimed
US-12617785-B2 Pyrrolo[2,3-b]pyridine-3-carboxamide compositions and methods for ameliorating hearing loss THE ROCKEFELLER UNIVERSITY (US) 2026-05-05 US disclosed
WO-1993023391-A1 SUBSTITUTED INDOLES AND AZAINDOLES AS ANGIOTENSIN II ANTAGONISTS SYNTEX (U.S.A.) INC. (US) 1993-11-25 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 (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-12617785-B2 Pyrrolo[2,3-b]pyridine-3-carboxamide compositions and methods for ameliorating hearing loss YAP1, LATS2, LATS1 MAP2K1 871/4885CAMKK2 43/4885ADORA2A 3422/4885
US-20040106641-A1 Novel 7-azaindoles, use thereof as phosphodiesterase 4 inhibitors and method for producing the same PDE4A, PDE4B, PDE4C MAP2K1 2469/4885CAMKK2 912/4885ADORA2A 518/4885
US-20080153837-A1 Novel Fluorene Derivatives, Composition Containing Said Derivatives and the Use Thereof HSP90B1, HSP90AB1, HSP90AA1 MAP2K1 3928/4885CAMKK2 1470/4885ADORA2A 3575/4885

“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.