SCHEMBL5463273

SCHEMBL5463273

CC(=O)c1cn(CCCCl)c2c(Cl)cccc12

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 1/20 0.47
PRPS1 P60891 1/20 0.47
KMT2A Q03164 1/20 0.44
CREBBP Q92793 2/20 0.43
CNR2 P34972 8/20 0.42
CNR1 P21554 5/20 0.41
POLB P06746 1/20 0.40
PKM P14618 1/20 0.40
NR2F2 P24468 1/20 0.40
BRD4 O60885 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL5445321 0.86 NR2F2 (0.48) SMN1; SMN2ALDH1A1KMT2ACREBBPCNR2
SCHEMBL5451167 0.85 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1KMT2ACREBBPCNR2
SCHEMBL5338984 0.85 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1PRPS1KMT2ACREBBP
SCHEMBL5332444 0.83 SMN1; SMN2 (0.59) SMN1; SMN2ALDH1A1KMT2ACNR2CNR1
SCHEMBL5373614 0.82 ALDH1A1 (0.51) SMN1; SMN2ALDH1A1KMT2ACREBBPCNR2
SCHEMBL5457605 0.79 SMN1; SMN2 (0.57) SMN1; SMN2ALDH1A1PRPS1KMT2APKM
SCHEMBL5332746 0.79 SMN1; SMN2 (0.71) SMN1; SMN2ALDH1A1KMT2ACREBBPCNR2
SCHEMBL5446902 0.78 ALDH1A1 (0.56) SMN1; SMN2ALDH1A1PRPS1KMT2APKM
SCHEMBL22450706 0.78 BRD4 (0.54) ALDH1A1PRPS1KMT2ACREBBPCNR1
SCHEMBL5453742 0.78 MEN1 (0.49) SMN1; SMN2ALDH1A1KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-09-13 US disclosed
US-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-09-13 US disclosed
US-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-09-13 US disclosed
WO-2007079239-A2 BICYCLIC NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-07-12 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 (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-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF GIPR, GHSR, GHRHR SMN1; SMN2 1701/4885ALDH1A1 2963/4885PRPS1 4276/4885

“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.