SCHEMBL954380

SCHEMBL954380

Cc1cc2nc(CCc3ccccc3F)cc(O)n2n1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.47
CXCR2 P25025 2/20 0.46
CASR P41180 1/20 0.41
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 3/20 0.38
HSD17B10 Q99714 1/20 0.38
TAAR1 Q96RJ0 1/20 0.37
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
LMNA P02545 1/20 0.36
PKM P14618 1/20 0.36
PDE2A O00408 1/20 0.35
DAO P14920 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL956581 0.90 CXCR2 (0.57) RXFP1CXCR2CASRALDH1A1MAPT
SCHEMBL3338499 0.81 CXCR2 (0.39) RXFP1CXCR2ALDH1A1KDM4EHSD17B10
SCHEMBL3341624 0.76 CXCR2 (0.50) RXFP1CXCR2
SCHEMBL956726 0.76 CXCR2 (0.53) CXCR2
SCHEMBL956740 0.76 TAAR1 (0.38) CXCR2CASRALDH1A1KDM4ETAAR1
SCHEMBL958516 0.76 CXCR2 (0.54) CXCR2ALDH1A1
SCHEMBL956304 0.76 CXCR2 (0.72) CXCR2PDE2A
SCHEMBL956296 0.75 CXCR2 (0.56) CXCR2
SCHEMBL956573 0.74 FFAR1 (0.50) RXFP1CXCR2MAPTLMNA
SCHEMBL954899 0.73 CXCR2 (0.54) CXCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009429-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF CXCR2 NOVARTIS AG (CH) 2011-01-13 US disclosed
EP-2257552-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF CXCR2 Novartis AG (CH) 2010-12-08 EP disclosed
WO-2009106539-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF CXCR2 NOVARTIS AG (CH) 2009-09-03 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 (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-20110009429-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF CXCR2 CXCR2, CXCR1, CXCR3 RXFP1 89/4885CXCR2 1/4885CASR 1818/4885

“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.