SCHEMBL3466097

SCHEMBL3466097

Oc1ccnc2cn[nH]c12

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.41
PTK2 Q05397 1/20 0.41
TGFBR1 P36897 8/20 0.36
CYP3A4 P08684 2/20 0.34
CYP2C8 P10632 2/20 0.34
MAPK14 Q16539 3/20 0.33
ACVR1 Q04771 1/20 0.32
TGFBR2 P37173 1/20 0.31
ABL2 P42684 1/20 0.31
CSNK1A1 P48729 1/20 0.31
CSNK1D P48730 1/20 0.31
MAP3K20 Q9NYL2 1/20 0.31
RAF1 P04049 2/20 0.31
BRAF P15056 2/20 0.31
MALT1 Q9UDY8 1/20 0.31
NOS1 P29475 2/20 0.31
IDO1 P14902 1/20 0.31
DYRK1A Q13627 1/20 0.31
DAO P14920 1/20 0.30

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
SCHEMBL29514304 0.75 NOS1 (0.47) HTTPTK2TGFBR1CYP3A4CYP2C8
SCHEMBL19152664 0.75 HTT (0.45) HTTPTK2TGFBR1CYP3A4CYP2C8
SCHEMBL2596969 0.75 NCF1 (0.41) HTTPTK2TGFBR1CYP3A4CYP2C8
SCHEMBL2598373 0.75 MAPKAPK2 (0.38) HTTPTK2TGFBR1CYP3A4CYP2C8
SCHEMBL3465347 0.75 NOS1 (0.47) HTTPTK2TGFBR1CYP3A4CYP2C8
SCHEMBL2598398 0.75 NOS1 (0.47) HTTPTK2TGFBR1CYP3A4CYP2C8
SCHEMBL29951183 0.75 HTT (0.41) HTTPTK2TGFBR1CYP3A4CYP2C8
SCHEMBL9073237 0.74 MAPT (0.38) HTTPTK2CYP3A4CSNK1A1NOS1
SCHEMBL23629251 0.73 KDM5A (0.50)
SCHEMBL23629273 0.72 BTK (0.54) PTK2CSNK1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12371430-B2 5-morpholin-4-yl-pyrazolo[4,3-b]pyridine derivatives MERCK PATENT GMBH (DE) 2025-07-29 US claimed
CN-116375701-A Bicyclic heterocyclic compounds, preparation method and application thereof 深圳微芯生物科技股份有限公司 2023-07-04 CN disclosed
EP-3846904-A1 5-MORPHOLIN-4-YL-PYRAZOLO[4,3-B]PYRIDINE DERIVATIVES Merck Patent GmbH (DE) 2021-07-14 EP disclosed
US-7652035-B2 CRF receptor antagonists and methods relating thereto Neurocrine Bioscience, Inc. (US) 2010-01-26 US disclosed
EP-1802621-B1 CRF RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO SMITHKLINE BEECHAM CORK LTD (IE) 2009-05-06 EP disclosed
US-20080064719-A1 Crf Receptor Antagonists And Methods Relating Thereto SMITHKLINE BEECHAM (CORK) LIMITED (IE) 2008-03-13 US disclosed
EP-1802621-A1 CRF RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO SB Pharmco Puerto Rico Inc. (PR) 2007-07-04 EP disclosed
WO-2006044821-A1 CRF RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO SB PHARMCO PUERTO RICO INC. (PR) 2006-04-27 WO disclosed
US-20040048866-A1 Indazole derivatives that are activators of soluble guanylate cyclase ABBOTT LABORATORIES 2004-03-11 US disclosed
WO-2003076408-A2 INDAZOLE DERIVATIVES THAT ARE ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE ABBOTT LABORATORIES (US) 2003-09-18 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-20040048866-A1 Indazole derivatives that are activators of soluble guanylate cyclase GUCY1B1, GUCY1A1, GUCY1A2 HTT 4614/4885PTK2 3430/4885TGFBR1 1076/4885
US-20080064719-A1 Crf Receptor Antagonists And Methods Relating Thereto CRHR1, CRHR2, SCTR HTT 946/4885PTK2 4477/4885TGFBR1 3601/4885
US-12371430-B2 5-morpholin-4-yl-pyrazolo[4,3-b]pyridine derivatives ATR, CDK1, CDKN1A HTT 3076/4885PTK2 1409/4885TGFBR1 718/4885

“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.