Sugi Predict

Sugi Predict / Compounds / SCHEMBL287705

SCHEMBL287705

SCHEMBL287705

Cc1cncc(C(=O)O)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.46
▸ HCAR2 Q8TDS4 5/20 0.45
▸ KDM4E B2RXH2 5/20 0.45
▸ NAPRT Q6XQN6 1/20 0.45
▸ ALOX15 P16050 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ TSHR P16473 3/20 0.39
▸ ACMSD Q8TDX5 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ HIF1A Q16665 1/20 0.38
▸ DAO P14920 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ PSMB5 P28074 1/20 0.35
▸ GPR35 Q9HC97 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35

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
SCHEMBL28215838 0.98 GRM5 (0.45) GRM5HCAR2KDM4ENAPRTALOX15
SCHEMBL69399 0.83 KDM4E (0.55) HCAR2KDM4ENAPRTALOX15ALDH1A1
SCHEMBL10307337 0.82 GRM5 (0.46) GRM5HCAR2KDM4ENAPRTALDH1A1
SCHEMBL29498786 0.82 GRM5 (0.46) GRM5HCAR2KDM4ENAPRTALDH1A1
SCHEMBL22711336 0.80 GRM5 (0.49) GRM5HCAR2KDM4EALDH1A1MAPK1
SCHEMBL3743154 0.80 ADORA3 (0.47) GRM5TSHRTDP1L3MBTL1ADORA3
Hydrochloric Acid SCHEMBL2673698 0.78 ADORA3 (0.45) GRM5TSHRTDP1L3MBTL1ADORA3
SCHEMBL8023082 0.77 GRM5 (0.43) GRM5HCAR2KDM4EPSMB5
SCHEMBL12094161 0.77 ATM (0.47) GRM5KDM4EALDH1A1MAPK1SMN1; SMN2
SCHEMBL30419529 0.77 ATM (0.47) GRM5KDM4EALDH1A1MAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117965239-A Preparation method of solid aroma-diving substance and aroma-diving type cigarette lap adhesive 河南中烟工业有限责任公司 2024-05-03 — — CN claimed
CN-109942762-B Preparation method of surface treating agent with flame retardant property 上海普信高分子材料有限公司 2021-10-22 — — CN claimed
CN-112352326-A Sputtered protective layer for organic electronic devices 斯马特凯姆有限公司 2021-02-09 — — CN claimed
CN-109942762-A A kind of preparation method of the surface treating agent with flame retardant property 上海普信高分子材料有限公司 2019-06-28 — — CN claimed
EP-2763980-B1 BICARBOCYCLIC AND TRICARBOCYCLIC ETHYNYL DERIVATIVES AND USES OF SAME H LUNDBECK AS (DK) 2018-04-25 — — EP claimed
EP-3263566-A1 BICYCLO[3.2.1]OCTYL AMIDE DERIVATIVES AS ALLOSTERIC MODULATORS OF THE METABOTROPIC GLUTAMATE RECEPTOR 5 (MGLU5 OR MGLUR5) FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM (CNS) DISORDERS H. Lundbeck A/S (DK) 2018-01-03 — — EP claimed
US-20170217950-A1 Bicyclo[3.2.1]Octyl Amide Derivatives and Uses of Same H. LUNDBECK A/S (DK) 2017-08-03 — — US claimed
EP-2654422-B1 Bicyclo[3.2.1]octyl amide derivatives as allosteric modulators of the metabotropic glutamate receptor 5 (mGlu5 or mGluR5) for the treatment of central nervous system (CNS) disorders H LUNDBECK AS (DK) 2017-08-02 — — EP claimed
US-9656975-B2 Bicyclo[3.2.1]octyl amide derivatives and uses of same H. LUNDBECK A/S (DK) 2017-05-23 — — US claimed
US-20160326154-A1 BICARBOCYCLIC AND TRICARBOCYCLIC ETHYNYL DERIVATIVES AND USES OF SAME H. LUNDBECK A/S (DK) 2016-11-10 — — US claimed
CN-1906489-A Optical storage medium with polymer film containing analyte and use thereof GEN ELECTRIC (US) 2007-01-31 — — CN claimed
CN-1898753-A Electrically conductive compositions, methods of manufacture thereof and articles derived from such compositions GEN ELECTRIC (US) 2007-01-17 — — CN claimed
CN-1886808-A Electrically conductive thermoplastic compositions, methods of manufacture thereof, and articles derived from such compositions GEN ELECTRIC (US) 2006-12-27 — — CN claimed
CN-1867591-A Conductive composition and method for producing same GEN ELECTRIC (US) 2006-11-22 — — CN claimed
CN-1800284-A Polishing compositions for reducing erosion in semiconductor wafers ROHM & HAAS ELECT MAT (US) 2006-07-12 — — CN claimed
CN-1699444-A Polishing compositions for controlling metal interconnect removal rate in semiconductor wafers ROHM & HAAS ELECT MAT (US) 2005-11-23 — — CN claimed
CN-1674293-A Memory devices based on electric field programmable films ROHM & HAAS (US) 2005-09-28 — — CN claimed
CN-1623772-A Multilayer article and method of making same GEN ELECTRIC (US) 2005-06-08 — — CN claimed
US-5213973-A MICROBIOLOGICAL PROCESS FOR OXIDATION OF METHYL GROUPS LONZA LTD. (CH) 1993-05-25 — — US claimed
EP-0466042-A2 Microbiological process for the oxidation of methyl groups LONZA AG (CH) 1992-01-15 — — EP claimed

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-20170217950-A1 Bicyclo[3.2.1]Octyl Amide Derivatives and Uses of Same SLC10A1, CLIC1, ABCB11 GRM5 3148/4885HCAR2 108/4885KDM4E 2751/4885
US-20160326154-A1 BICARBOCYCLIC AND TRICARBOCYCLIC ETHYNYL DERIVATIVES AND USES OF SAME CBR1, CYCS, CYP3A43 GRM5 3000/4885HCAR2 194/4885KDM4E 2642/4885

“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.