SCHEMBL6621385

SCHEMBL6621385

O=C(O)CCC1CCC2(CCNCC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 13/20 0.41
ITGA2B P08514 13/20 0.41
ADRA2C P18825 1/20 0.40
FFAR4 Q5NUL3 3/20 0.39
F2R P25116 5/20 0.37
SLC6A1 P30531 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRB2 P47870 1/20 0.35
SLC6A12 P48065 1/20 0.35
SLC6A11 P48066 1/20 0.35
SLC6A13 Q9NSD5 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
SCHEMBL361304 0.81 SLC6A1 (0.50) FFAR4SLC6A1GABRA5GABRB2SLC6A12
SCHEMBL954535 0.81 ITGB3 (0.56) ITGB3ITGA2BF2RSLC6A1GABRA5
SCHEMBL23603991 0.80 FFAR4 (0.40) FFAR4
Hydrochloric Acid SCHEMBL3159636 0.79 ITGB3 (0.54) ITGB3ITGA2BF2RSLC6A1GABRA5
SCHEMBL16466404 0.78 ALDH1A1 (0.39) ADRA2C
SCHEMBL27118478 0.77 FFAR4 (0.35) ADRA2CFFAR4
Acetic Acid SCHEMBL9210574 0.76 ITGB3 (0.51) ITGB3ITGA2BF2RSLC6A1GABRA5
SCHEMBL26105435 0.74 KDM1A (0.33)
SCHEMBL5495308 0.74 ITGB3 (0.50) ITGB3ITGA2BF2RSLC6A1GABRA5
SCHEMBL30864009 0.74 KDM1A (0.33) ITGB3ITGA2BADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2906542-B1 SUBSTITUTED SPIROPIPERIDINYL COMPOUNDS USEFUL AS GPR120 AGONISTS MERCK SHARP & DOHME (US) 2019-08-07 EP disclosed
US-9708270-B2 Substituted spiropiperidinyl compounds useful as GPR120 agonists MERCK SHARP & DOHME CORP. (US) 2017-07-18 US disclosed
US-20150274672-A1 SUBSTITUTED SPIROPIPERIDINYL COMPOUNDS USEFUL AS GPR120 AGONISTS MERCK SHARP & DOHME CORP. (US) 2015-10-01 US disclosed
EP-2906542-A2 SUBSTITUTED SPIROPIPERIDINYL COMPOUNDS USEFUL AS GPR120 AGONISTS Merck Sharp & Dohme Corp. (US) 2015-08-19 EP disclosed
WO-2014059232-A2 SUBSTITUTED SPIROPIPERIDINYL COMPOUNDS USEFUL AS GPR120 AGONISTS MERCK SHARP & DOHME CORP. (US) 2014-04-17 WO disclosed
EP-0854869-B1 SPIRO COMPOUNDS AS INHIBITORS OF FIBRINOGEN-DEPENDENT PLATELET AGGREGATION LILLY CO ELI (US) 2004-08-25 EP disclosed
US-6528534-B2 Useful as glycoprotein IIb/IIIa antagonists for prophylaxis thrombosis, therapy of atheroschlerosis, arterioschlerosis, acute myocardial infarction, chronic stable angina, unstable angina, transient ischemic attacks and strokes MILLENNIUM PHARMACEUTICALS, INC. 2003-03-04 US disclosed
US-20020013325-A1 Spiro compounds as inhibitors of fibrinogen-dependent platelet aggregation FISHER MATTHEW J (US) 2002-01-31 US disclosed
US-6291469-B1 Spiro compounds as inhibitors of fibrinogen-dependent platelet aggregation ELI LILLY AND COMPANY 2001-09-18 US disclosed
EP-0854869-A1 SPIRO COMPOUNDS AS INHIBITORS OF FIBRINOGEN-DEPENDENT PLATELET AGGREGATION ELI LILLY AND COMPANY (US) 1998-07-29 EP disclosed
WO-1997011940-A1 SPIRO COMPOUNDS AS INHIBITORS OF FIBRINOGEN-DEPENDENT PLATELET AGGREGATION ELI LILLY AND COMPANY (US) 1997-04-03 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 (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-20150274672-A1 SUBSTITUTED SPIROPIPERIDINYL COMPOUNDS USEFUL AS GPR120 AGONISTS GPR119, GPR180, GPR88 ITGB3 2393/4885ITGA2B 1793/4885ADRA2C 79/4885
US-20020013325-A1 Spiro compounds as inhibitors of fibrinogen-dependent platelet aggregation PF4, PFKP, SELP ITGB3 57/4885ITGA2B 44/4885ADRA2C 1618/4885

“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.