SCHEMBL7895370

SCHEMBL7895370

CCc1ccc(-c2cn[nH]c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT2 P31751 8/20 0.59
AKT1 P31749 5/20 0.55
METAP2 P50579 1/20 0.55
ROCK2 O75116 6/20 0.45
KDR P35968 1/20 0.44
TEK Q02763 1/20 0.44
PRKACA P17612 2/20 0.43
AKT3 Q9Y243 2/20 0.43
RPS6KA5 O75582 1/20 0.43
RPS6KA4 O75676 1/20 0.43
LATS1 O95835 1/20 0.43
PRKACB P22694 1/20 0.43
RPS6KB1 P23443 1/20 0.43
GRK2 P25098 1/20 0.43
RPS6KA3 P51812 1/20 0.43
PRKCD Q05655 1/20 0.43
ROCK1 Q13464 1/20 0.43
RPS6KA2 Q15349 1/20 0.43
RPS6KA1 Q15418 1/20 0.43
PKN1 Q16512 1/20 0.43

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
SCHEMBL14477464 0.85 AKT2 (0.65) AKT2AKT1ROCK2
SCHEMBL15689115 0.82 AKT2 (0.76) AKT2AKT1ROCK2PRKACAAKT3
SCHEMBL16432987 0.82 AKT2 (0.76) AKT2AKT1ROCK2PRKACAAKT3
SCHEMBL14906694 0.82 RAB9A (0.50) AKT2AKT1METAP2PIM1PIM3
SCHEMBL24271249 0.80 AKT2 (0.59) AKT2AKT1ROCK2PRKACAAKT3
SCHEMBL2527619 0.80 AKT2 (0.59) AKT2AKT1ROCK2TEKPRKACA
SCHEMBL7998694 0.78 IDO1 (0.59) AKT2AKT1ROCK2KDRTEK
SCHEMBL10272396 0.77 AKT2 (0.42) AKT2AKT1KDRTEKPIM1
SCHEMBL844167 0.77 AKT2 (0.61) AKT2AKT1METAP2ROCK2KDR
SCHEMBL15504532 0.77 AKT2 (0.61) AKT2AKT1METAP2ROCK2KDR

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365582-A1 NOVEL COMPOUNDS HAVING INHIBITORY ACTIVITY ON PROSTAGLANDIN E2 RECEPTOR AND USES THEREOF KANAPH THERAPEUTICS INC. (KR) 2023-11-16 US disclosed
US-20230365582-A1 NOVEL COMPOUNDS HAVING INHIBITORY ACTIVITY ON PROSTAGLANDIN E2 RECEPTOR AND USES THEREOF KANAPH THERAPEUTICS INC. (KR) 2023-11-16 US disclosed
US-20230158025-A1 GALACTOKINASE INHIBITORS NATIONAL INSTITUTES OF HEALTH 2023-05-25 US disclosed
EP-3242873-B1 CYCLIC UREAS AS INHIBITORS OF ROCK BRISTOL MYERS SQUIBB CO (US) 2020-07-22 EP disclosed
US-20190315772-A1 GLUCOSE UPTAKE INHIBITORS KADMON CORP LLC (US) 2019-10-17 US disclosed
EP-2373634-B1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARM CO LTD (JP) 2015-11-11 EP disclosed
US-20110135650-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-06-09 US disclosed
WO-2010065717-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-06-10 WO disclosed
US-7667036-B2 MAPKAP-K2 (mitogen-activated protein kinase-activated protein kinase 2) inhibitors; inflammatory, autoimmune disease, destructive bone disorder, cancer and/or tumor growth; angiogenesis, diabetes and neurological disorders TEIJIN PHARMA LIMITED (JP) 2010-02-23 US disclosed
US-7557110-B2 MAPKAP-K2; inflammatory disease, autoimmune disease, destructive bone disorder, cancer and/or tumour growth; 5-[(trans-4-aminocyclohexyl)amino]-3-fluoro-6-methyl(pyrazolo[1,5-a]pyri- midin-7-yl)}(4-iodophenyl)amine TEIJIN PHARMA LIMITED (JP) 2009-07-07 US disclosed
WO-2008021926-A2 MODULATORS OF GLUCOCORTICOID RECEPTOR, AND/OR AP-1, AND/OR NF-KB ACTIVITY AND USE THEREOF BRISTOL-MYERS SQUIBB COMPANY (US) 2008-02-21 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 (4 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-20110135650-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS SERPINC1, F9, F8 AKT2 4319/4885AKT1 4310/4885METAP2 497/4885
US-20230158025-A1 GALACTOKINASE INHIBITORS GALK1, GCK, GCKR AKT2 1163/4885AKT1 852/4885METAP2 1889/4885
US-20230365582-A1 NOVEL COMPOUNDS HAVING INHIBITORY ACTIVITY ON PROSTAGLANDIN E2 RECEPTOR AND USES THEREOF PTGER1, PTGIR, PTGDR2 AKT2 1207/4885AKT1 2017/4885METAP2 1238/4885
US-20190315772-A1 GLUCOSE UPTAKE INHIBITORS SLC2A1, SLC2A4, SLC2A2 AKT2 1440/4885AKT1 1635/4885METAP2 2264/4885

“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.