SCHEMBL4433834

SCHEMBL4433834

OCc1cn(-c2ccccc2)cn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 5/20 0.50
CPB1 P15086 3/20 0.50
PDE3B Q13370 1/20 0.49
PDE3A Q14432 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
NOTUM Q6P988 1/20 0.49
P2RX7 Q99572 1/20 0.44
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
NLRP3 Q96P20 1/20 0.41
PDE10A Q9Y233 1/20 0.39
CYP3A4 P08684 1/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
USP2 O75604 1/20 0.38
HPGD P15428 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38
COMT P21964 1/20 0.37

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
SCHEMBL4427934 0.90 PDE3B (0.54) CPB2CPB1PDE3BPDE3AL3MBTL1
SCHEMBL7671977 0.85 LTA4H (0.46) CPB2CPB1PDE3BPDE3AL3MBTL1
SCHEMBL4424319 0.82 CYP1A2 (0.49) PDE3BPDE3AL3MBTL1NPC1RAB9A
SCHEMBL3426575 0.81 PDE3B (0.50) CPB2CPB1PDE3BPDE3ANOTUM
SCHEMBL4432563 0.81 NOTUM (0.51) CPB2CPB1PDE3BPDE3ANOTUM
SCHEMBL27749290 0.81 PDE3B (0.47) CPB2CPB1PDE3BPDE3AL3MBTL1
SCHEMBL4428918 0.81 PDE3B (0.53) CPB2CPB1PDE3BPDE3ANOTUM
SCHEMBL2173293 0.81 PDE3B (0.50) CPB2CPB1PDE3BPDE3ANOTUM
SCHEMBL1698763 0.81 PDE3B (0.50) CPB2CPB1PDE3BPDE3AL3MBTL1
SCHEMBL4434213 0.81 NOTUM (0.51) CPB2CPB1PDE3BPDE3ANOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US claimed
US-20240246937-A1 IL4I1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2024-07-25 US disclosed
EP-4329889-A1 IL4I1 INHIBITORS AND METHODS OF USE Merck Sharp & Dohme LLC (US) 2024-03-06 EP disclosed
US-20230406830-A1 [6,6] FUSED BICYCLIC HDAC8 INHIBITORS Valo Health, LLC 2023-12-21 US disclosed
WO-2022232333-A1 IL4I1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2022-11-03 WO disclosed
US-11414392-B2 [6,6] fused bicyclic HDAC8 inhibitors VALO HEALTH, INC. (US) 2022-08-16 US disclosed
US-20210139439-A1 [6,6] FUSED BICYCLIC HDAC8 INHIBITORS VALO HEALTH, INC. 2021-05-13 US disclosed
US-20210139439-A1 [6,6] FUSED BICYCLIC HDAC8 INHIBITORS VALO HEALTH, INC. 2021-05-13 US disclosed
US-10829460-B2 [6,6] fused bicyclic HDAC8 inhibitors VALO EARLY DISCOVERY, INC. (US) 2020-11-10 US disclosed
US-10829460-B2 [6,6] fused bicyclic HDAC8 inhibitors VALO EARLY DISCOVERY, INC. (US) 2020-11-10 US disclosed
US-20030187268-A1 Imidazole derivatives EVOTEC INTERNATIONAL GMBH (DE) 2003-10-02 US disclosed
US-6610723-B2 Such as 3-(3,4-dimethyl-phenyl)-5-(2-methyl-imidazol-1-yl-methyl)-pyridine having affinity to N-methyl-D-aspartate-receptor subtype selective blockers; central nervous system; learning, memory, neurodegeneration HOFFMANN-LA ROCHE INC. 2003-08-26 US disclosed
US-20020151715-A1 Imidazole derivatives EVOTEC INTERNATIONAL GMBH (DE) 2002-10-17 US disclosed
WO-2002060877-A1 IMIDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-08-08 WO disclosed
US-6002005-A Certain 1-substituted aminomethyl imidazole and pyrrole derivatives: novel dopamine receptor subtype specific ligands NEUROGEN CORPORATION (US) 1999-12-14 US disclosed
US-5760234-A THERAPY FOR NERVOUS SYSTEM DISORDERS NEUROGEN CORPORATION (US) 1998-06-02 US disclosed
US-5750700-A COMPOUNDS FOR TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS SUCH AS SCHIZOPHRENIA, NEUROLEPTIC AGENTS FOR BINDING TO DOPAMINE RECEPTORS NEUROGEN CORPORATION (US) 1998-05-12 US disclosed
US-5478934-A Treating central nervous system disorders NEUROGEN CORPORATION 1995-12-26 US disclosed
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US disclosed
EP-0024829-A1 4-Benzyl- and 4-benzoylimidazole derivatives, processes for their preparation and pharmaceutical compositions comprising the same Farmos-Yhtyma Oy (FI) 1981-03-11 EP 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 (7 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-20230406830-A1 [6,6] FUSED BICYCLIC HDAC8 INHIBITORS HDAC8, HDAC3, HDAC2 CPB2 3741/4885CPB1 4092/4885PDE3B 3706/4885
US-20210139439-A1 [6,6] FUSED BICYCLIC HDAC8 INHIBITORS HDAC8, HDAC3, HDAC2 CPB2 3741/4885CPB1 4092/4885PDE3B 3706/4885
US-20020151715-A1 Imidazole derivatives GRIN2B, GRIN1, GRIN2A CPB2 4623/4885CPB1 4173/4885PDE3B 1701/4885
US-11414392-B2 [6,6] fused bicyclic HDAC8 inhibitors HDAC8, HDAC3, HDAC2 CPB2 3741/4885CPB1 4092/4885PDE3B 3706/4885
US-10829460-B2 [6,6] fused bicyclic HDAC8 inhibitors HDAC8, HDAC1, HDAC2 CPB2 3231/4885CPB1 3463/4885PDE3B 4207/4885
US-20240246937-A1 IL4I1 INHIBITORS AND METHODS OF USE IL4I1, IL4, IL2 CPB2 1999/4885CPB1 1745/4885PDE3B 1527/4885
US-20030187268-A1 Imidazole derivatives GRIN2B, GRIN1, GRIN2A CPB2 4623/4885CPB1 4173/4885PDE3B 1701/4885

“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.