SCHEMBL1970171

SCHEMBL1970171

CC(C)(C)OC(=O)NCC1CCN(CC2(C(=O)O)CCOCC2)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.42
CKS1B P61024 1/20 0.41
SKP1 P63208 1/20 0.41
SKP2 Q13309 1/20 0.41
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
HTR4 Q13639 4/20 0.38
KMT2A Q03164 1/20 0.38
ACACB O00763 6/20 0.37
ACACA Q13085 6/20 0.37
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
NPC1L1 Q9UHC9 1/20 0.36

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
SCHEMBL1970214 0.92 DRD2 (0.46) DRD2CKS1BSKP1SKP2KDM4E
SCHEMBL1973209 0.90 DRD2 (0.41) DRD2CKS1BSKP1SKP2KDM4E
SCHEMBL1972235 0.90 DRD2 (0.44) DRD2CKS1BSKP1SKP2KDM4E
SCHEMBL3295757 0.90 DRD2 (0.44) DRD2CKS1BSKP1SKP2KDM4E
SCHEMBL8276758 0.86 HTR4 (0.50) DRD2CKS1BSKP1SKP2KDM4E
SCHEMBL3293795 0.82 DRD2 (0.46) DRD2CKS1BSKP1SKP2KDM4E
SCHEMBL1973738 0.80 DRD2 (0.43) DRD2CKS1BSKP1SKP2KDM4E
SCHEMBL1971371 0.80 DRD2 (0.43) DRD2CKS1BSKP1SKP2KDM4E
SCHEMBL14382476 0.79 DRD2 (0.55) DRD2CKS1BSKP1SKP2KDM4E
SCHEMBL2989855 0.79 DRD2 (0.43) DRD2CKS1BSKP1SKP2KDM4E

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-1856110-B1 OXYINDOLE DERIVATIVES AS 5HT4 RECEPTOR AGONISTS PFIZER (US) 2011-06-22 EP disclosed
US-20100173925-A1 OXYINDOLE DERIVATIVES PFIZER INC 2010-07-08 US disclosed
US-7737163-B2 Benzimidazolone carboxylic acid derivatives PFIZER INC. (US) 2010-06-15 US disclosed
US-7705020-B2 Benzimidazolone carboxylic acid derivatives PFIZER INC. (US) 2010-04-27 US disclosed
US-7595329-B2 Benzimidazolone carboxylic acid derivatives PFIZER INC (US) 2009-09-29 US disclosed
US-7589109-B2 Oxyindole derivatives PFIZER INC (US) 2009-09-15 US disclosed
US-20080108660-A1 Benzimidazolone Carboxylic Acid Derivatives PFIZER INC 2008-05-08 US disclosed
US-20060194842-A1 Oxyindole derivatives PFIZER INC. 2006-08-31 US disclosed
US-20050277672-A1 Benzimidazolone carboxylic acid derivatives PFIZER INC 2005-12-15 US disclosed
US-20050277671-A1 Benzimidazolone carboxylic acid derivatives PFIZER INC 2005-12-15 US disclosed
US-20050277673-A1 Benzimidazolone carboxylic acid derivatives PFIZER JAPAN INC. (JP) 2005-12-15 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 (6 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-20100173925-A1 OXYINDOLE DERIVATIVES HTR4, HTR5A, HRH4 DRD2 146/4885CKS1B 3846/4885SKP1 1679/4885
US-20050277673-A1 Benzimidazolone carboxylic acid derivatives HRH2, HRH4, GPR4 DRD2 1161/4885CKS1B 1713/4885SKP1 796/4885
US-20050277672-A1 Benzimidazolone carboxylic acid derivatives HRH2, HRH4, GPR4 DRD2 1161/4885CKS1B 1713/4885SKP1 796/4885
US-20060194842-A1 Oxyindole derivatives HTR4, HTR5A, HRH4 DRD2 146/4885CKS1B 3846/4885SKP1 1679/4885
US-20050277671-A1 Benzimidazolone carboxylic acid derivatives HRH2, HRH4, GPR4 DRD2 1161/4885CKS1B 1713/4885SKP1 796/4885
US-20080108660-A1 Benzimidazolone Carboxylic Acid Derivatives HRH2, HRH4, GPR4 DRD2 1305/4885CKS1B 1624/4885SKP1 808/4885

“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.