SCHEMBL5564260

SCHEMBL5564260

Cc1ccc(-c2nn(Cc3ccccc3)c3ccccc23)o1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 10/20 1.00
CYP1A2 P05177 3/20 0.69
CYP2D6 P10635 3/20 0.69
CYP3A4 P08684 2/20 0.69
KDM4E B2RXH2 2/20 0.69
NPC1 O15118 2/20 0.69
ALDH1A1 P00352 2/20 0.69
MAPT P10636 2/20 0.69
HPGD P15428 2/20 0.69
RAB9A P51151 2/20 0.69
SMN1; SMN2 Q16637 2/20 0.69
GMNN O75496 1/20 0.69
LMNA P02545 1/20 0.69
TP53 P04637 1/20 0.69
CYP2C9 P11712 1/20 0.69
ALOX15 P16050 1/20 0.69
NFKB1 P19838 1/20 0.69
MAPK1 P28482 1/20 0.69
CYP2C19 P33261 1/20 0.69
BLM P54132 1/20 0.69

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
SCHEMBL17199435 0.90 PDE5A (0.81) PDE5ACYP1A2CYP2D6CYP3A4KDM4E
SCHEMBL17183866 0.87 PDE5A (0.76) PDE5ACYP1A2CYP2D6CYP3A4KDM4E
SCHEMBL30694993 0.87 PDE5A (0.76) PDE5ACYP1A2CYP2D6CYP3A4KDM4E
SCHEMBL27661131 0.86 PDE5A (0.75) PDE5ACYP1A2CYP2D6CYP3A4KDM4E
SCHEMBL10252544 0.84 PDE5A (0.77) PDE5ACYP1A2CYP2D6CYP3A4KDM4E
SCHEMBL3077928 0.82 PDE5A (0.70) PDE5ACYP1A2CYP2D6CYP3A4KDM4E
SCHEMBL3070629 0.82 PDE5A (0.70) PDE5ACYP1A2CYP2D6CYP3A4KDM4E
SCHEMBL187837 0.82 PDE5A (1.00) PDE5ACYP1A2CYP2D6CYP3A4KDM4E
SCHEMBL1900992 0.82 PDE5A (0.70) PDE5ACYP1A2CYP2D6CYP3A4KDM4E
SCHEMBL29352550 0.82 PDE5A (1.00) PDE5ACYP1A2CYP2D6CYP3A4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140163082-A1 PYRAZOLYL COMPOUNDS FOR USE IN REVERSING REACTIVE GLIOSIS KING KHALID EYE SPECIALIST HOSPITAL (SA) 2014-06-12 US claimed
CN-1842332-A Compounds, compositions and methods HIF BIO INC (US) 2006-10-04 CN claimed
EP-1646382-A2 COMPOUNDS, COMPOSITIONS AND METHODS HIF BIO INC. (US) 2006-04-19 EP claimed
EP-0932403-B1 CONDENSED (HETARYL-SUBSTITUTED) 1-BENZYL-3-PYRAZOL DERIVATES FOR TREATING DISEASES OF THE CARDIOVASCULAR AND CENTRAL NERVOUS SYSTEMS BAYER HEALTHCARE AG (DE) 2005-11-30 EP claimed
US-20050187276-A1 Compounds, compositions and methods BIZBIOTECH CO., LTD. (KR) 2005-08-25 US claimed
WO-2005030121-A2 COMPOUNDS, COMPOSITIONS AND METHODS HIF BIO, INC. (US) 2005-04-07 WO claimed
US-6180656-B1 CARDIOVASCULAR DISORDERS; NERVOUS SYSTEM DISORDERS BAYER AKTIENGESELLSCHAFT (DE) 2001-01-30 US claimed
CN-1240354-A Use of condensated (hetaryl-substituted) 1-benzal-3-pyarzol derivates for treating special diseases of the cardiovascular and the central nerous systems BAYER AG (DE) 2000-01-05 CN claimed
EP-0932403-A1 USE OF CONDENSATED (HETARYL-SUBSTITUTED) 1-BENZAL-3-PYRAZOL DERIVATES FOR TREATING SPECIAL DISEASES OF THE CARDIOVASCULAR AND THE CENTRAL NERVOUS SYSTEMS BAYER AG (DE) 1999-08-04 EP claimed
WO-1998016223-A1 USE OF CONDENSATED (HETARYL-SUBSTITUTED) 1-BENZAL-3-PYRAZOL DERIVATES FOR TREATING SPECIAL DISEASES OF THE CARDIOVASCULAR AND THE CENTRAL NERVOUS SYSTEMS BAYER AKTIENGESELLSCHAFT (DE) 1998-04-23 WO claimed
EP-3998260-A1 SGC STIMULATORS Cyclerion Therapeutics, Inc. (US) 2022-05-18 EP disclosed
EP-3660013-A1 SGC STIMULATORS Cyclerion Therapeutics, Inc. (US) 2020-06-03 EP disclosed
US-20140163082-A1 PYRAZOLYL COMPOUNDS FOR USE IN REVERSING REACTIVE GLIOSIS KING KHALID EYE SPECIALIST HOSPITAL (SA) 2014-06-12 US disclosed
EP-1331223-B1 Method of treating sepsis YUNG SHIN PHARMACEUTICAL IND (TW) 2008-02-13 EP disclosed
US-7226941-B2 Compound for treating angiogenesis HIF BIO, INC. (US) 2007-06-05 US disclosed
CN-1842332-A Compounds, compositions and methods HIF BIO INC (US) 2006-10-04 CN disclosed
US-20050187276-A1 Compounds, compositions and methods BIZBIOTECH CO., LTD. (KR) 2005-08-25 US 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 (2 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-20140163082-A1 PYRAZOLYL COMPOUNDS FOR USE IN REVERSING REACTIVE GLIOSIS HMOX1, GPX1, GLRX3 PDE5A 936/4885CYP1A2 2004/4885CYP2D6 3955/4885
US-20050187276-A1 Compounds, compositions and methods HIF1A, HIF1AN, EGLN3 PDE5A 1987/4885CYP1A2 2118/4885CYP2D6 3521/4885

“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.