SCHEMBL16002960

SCHEMBL16002960

CNC1CCN(C(=O)c2nccc3ccccc23)CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CCR3 P51677 2/20 0.51
▸ CHRM2 P08172 1/20 0.51
▸ SYK P43405 1/20 0.50
▸ PDE2A O00408 1/20 0.48
▸ HCRTR1 O43613 1/20 0.46
▸ HTR2C P28335 3/20 0.43
▸ DRD2 P14416 1/20 0.43
▸ DRD4 P21917 1/20 0.43
▸ DRD3 P35462 1/20 0.43
▸ EPHX2 P34913 1/20 0.42
▸ NOS3 P29474 1/20 0.42
▸ NOS1 P29475 1/20 0.42
▸ NOS2 P35228 1/20 0.42
▸ CNR2 P34972 1/20 0.41

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
SCHEMBL16000500 0.88 CHRM2 (0.54) CCR3CHRM2SYKPDE2AHCRTR1
SCHEMBL16002985 0.84 SYK (0.50) CHRM2SYKHCRTR1EPHX2NOS3
SCHEMBL22345137 0.80 PDE2A (0.51) CCR3CHRM2PDE2AHTR2C
SCHEMBL16002915 0.79 ALDH1A1 (0.57) —
SCHEMBL16002921 0.78 CHRM2 (0.52) CCR3CHRM2SYKPDE2A
SCHEMBL16002997 0.75 RBP4 (0.59) —
SCHEMBL16003044 0.75 EPHX2 (0.68) EPHX2NOS2
SCHEMBL1810106 0.75 CCR3 (0.51) CCR3CHRM2HCRTR1EPHX2
SCHEMBL1810231 0.75 CCR3 (0.46) CCR3CHRM2
SCHEMBL3999037 0.74 EPHX1 (0.51) CCR3CHRM2EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9145391-B2 Bipyridylaminopyridines as Syk inhibitors MERCK SHARP & DOHME CORP. (US) 2015-09-29 — — US disclosed
US-20140249130-A1 BIPYRIDYLAMINOPYRIDINES AS SYK INHIBITORS MERCK SHARP & DOHME LLC 2014-09-04 — — 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 (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-20140249130-A1 BIPYRIDYLAMINOPYRIDINES AS SYK INHIBITORS SYK, BTK, LCK CCR3 2987/4885CHRM2 788/4885SYK 1/4885

“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.

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