SCHEMBL3664232

SCHEMBL3664232

O=C(O)c1cn2c(n1)CCC(c1ccc(F)cc1)C2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 2/20 0.44
ADRA1A P35348 1/20 0.41
RAB9A P51151 4/20 0.40
NPC1 O15118 3/20 0.40
ATM Q13315 1/20 0.40
HDAC1 Q13547 1/20 0.38
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
SLC18A3 Q16572 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
DRD2 P14416 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
PROKR1 Q8TCW9 1/20 0.35
COMT P21964 1/20 0.34

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
SCHEMBL3664098 0.88 ADRA1A (0.54) ADRA1ARAB9ANPC1MAPTSMN1; SMN2
SCHEMBL4029675 0.87 ADRA1A (0.41) ADRA1ARAB9ANPC1MAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL4090130 0.86 ADRA1A (0.52) ADRA1ARAB9ANPC1MAPTSMN1; SMN2
SCHEMBL4026557 0.86 USP5 (0.40) HDAC2ADRA1AHDAC1SMN1; SMN2L3MBTL1
SCHEMBL4028305 0.85 SCD5 (0.45) HDAC2ADRA1ANPC1HCAR2
SCHEMBL3665381 0.84 ADRA1A (0.44) ADRA1ARAB9ANPC1MAPTSMN1; SMN2
SCHEMBL4026155 0.84 NPC1 (0.41) ADRA1ARAB9ANPC1MAPTSMN1; SMN2
SCHEMBL3665069 0.83 HTR7 (0.39) HDAC2ADRA1AHDAC1SMN1; SMN2L3MBTL1
SCHEMBL4027548 0.83 HCAR2 (0.47) HDAC2HDAC1SMN1; SMN2GAAKMT2A
SCHEMBL3665949 0.83 ADRA1A (0.43) ADRA1ARAB9ANPC1SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111542523-B Heterocyclic compounds as PRMT5 inhibitors 朱比连特埃皮斯科瑞有限责任公司 2024-03-29 CN disclosed
CN-111542523-A Heterocyclic compounds as PRMT5 inhibitors 朱比连特埃皮斯科瑞有限责任公司 2020-08-14 CN disclosed
US-8288424-B2 Substituted tetrahydroimidazopyridine compounds and the use thereof in the treatment of pain and other conditions GRUENENTHAL GMBH (DE) 2012-10-16 US disclosed
EP-2235013-B1 SUBSTITUTED TETRAHYDROIMIDAZOPYRIDINE COMPOUNDS AND THE USE THEREOF IN PHARMACEUTICALS GRUENENTHAL GMBH (DE) 2012-08-01 EP disclosed
EP-2235013-A1 SUBSTITUTED TETRAHYDROIMIDAZOPYRIDINE COMPOUNDS AND THE USE THEREOF IN PHARMACEUTICALS Grünenthal GmbH (DE) 2010-10-06 EP disclosed
WO-2009092565-A1 SUBSTITUTED TETRAHYDROIMIDAZOPYRIDINE COMPOUNDS AND THE USE THEREOF IN PHARMACEUTICALS Grünenthal GmbH (DE) 2009-07-30 WO disclosed
EP-2083009-A1 Substituted tetrahydroimidazopyridine compounds and their use in medicine Grünenthal GmbH (DE) 2009-07-29 EP disclosed
US-20090186902-A1 Substituted Tetrahydroimidazopyridine Compounds and the Use Thereof in the Treatment of Pain and Other Conditions GRUENENTHAL GMBH (DE) 2009-07-23 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 (1 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-20090186902-A1 Substituted Tetrahydroimidazopyridine Compounds and the Use Thereof in the Treatment of Pain and Other Conditions HRH4, TRPV1, QDPR HDAC2 670/4885ADRA1A 517/4885RAB9A 1304/4885

“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.