SCHEMBL4903448

SCHEMBL4903448

CCC(C)OP(=O)(O)Cc1ccncc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.41
FDPS P14324 2/20 0.39
LMNA P02545 4/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
ALPL P05186 1/20 0.34
ALPI P09923 1/20 0.34
ALPG P10696 1/20 0.34
HTT P42858 1/20 0.34
GAA P10253 1/20 0.34
NAMPT P43490 1/20 0.34
ALDH1A1 P00352 1/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL1407856 0.84 TRPA1 (0.42) HPGD
SCHEMBL915243 0.83 PGK1 (0.37) LMNAHPGDSMN1; SMN2GAARAB9A
SCHEMBL915165 0.83 ESR1 (0.38) LMNAMAPT
SCHEMBL1760139 0.81 PGK1 (0.36) SMN1; SMN2
SCHEMBL1334895 0.81 FPR2 (0.38) LMNASMN1; SMN2GAAALDH1A1RAB9A
SCHEMBL4633893 0.81 TRPA1 (0.40) LMNAHPGDHTTALDH1A1
SCHEMBL915104 0.81 FDPS (0.40) FDPSLMNASMN1; SMN2ALDH1A1RAB9A
SCHEMBL917066 0.81 HTT (0.37) FDPSHPGDSMN1; SMN2HTTGAA
SCHEMBL13279876 0.81 PGK1 (0.42) ALDH1A1
SCHEMBL914038 0.80 ANPEP (0.44) SMN1; SMN2HTTALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080312281-A1 G-Protein Coupled Receptor (Gpr116) Agonists and Use Thereof for Treating Obesity and Diabetes PROSIDION LIMITED (GB) 2008-12-18 US disclosed
EP-1838311-A1 G-PROTEIN COUPLED RECEPTOR (GPR116) AGONISTS AND USE THEREOF FOR TREATING OBESITY AND DIABETES Prosidion Limited (GB) 2007-10-03 EP disclosed
WO-2006067531-A1 G-PROTEIN COUPLED RECEPTOR (GPR116) AGONISTS AND USE THEREOF FOR TREATING OBESITY AND DIABETES PROSIDION LTD (GB) 2006-06-29 WO disclosed
US-6974870-B2 Substituted 3-amino-thieno [2,3-b]pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses BOEHRINGER INGELHEIM PHAMACEUTICALS, INC. (US) 2005-12-13 US disclosed
US-20040180922-A1 Substituted 3-amino-thieno [2,3-b]pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2004-09-16 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 (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-20080312281-A1 G-Protein Coupled Receptor (Gpr116) Agonists and Use Thereof for Treating Obesity and Diabetes GPR119, GCGR, GPR65 CYP19A1 635/4885FDPS 3111/4885LMNA 4369/4885
US-20040180922-A1 Substituted 3-amino-thieno [2,3-b]pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses NFKBIA, IKBKB, CHUK CYP19A1 2280/4885FDPS 1292/4885LMNA 3819/4885

“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.