SCHEMBL620404

SCHEMBL620404

COc1ccc2ncc(SCCN3CCC(N)CC3)nc2c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 9/20 0.47
KDR P35968 9/20 0.47
FGFR1 P11362 8/20 0.47
FGFR2 P21802 7/20 0.47
FGFR4 P22455 7/20 0.47
FLT3 P36888 1/20 0.41
DRD2 P14416 2/20 0.38
DRD4 P21917 2/20 0.38
DRD3 P35462 2/20 0.38
DCTPP1 Q9H773 1/20 0.38
LTA4H P09960 1/20 0.37
SSTR2 P30874 1/20 0.37
KCNH2 Q12809 2/20 0.37
PDGFRB P09619 1/20 0.37
PDGFRA P16234 1/20 0.37

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
SCHEMBL621993 0.90 FGFR1 (0.39) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL15662658 0.88 FGFR3 (0.49) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL621994 0.88 FGFR1 (0.41) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL3707718 0.87 KMT2A (0.47) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL15662647 0.85 KCNH2 (0.39) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL621758 0.84 FGFR3 (0.45) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL15662296 0.82 FGFR1 (0.39) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL622368 0.81 FGFR3 (0.49) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL1742281 0.81 FGFR1 (0.41) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL622022 0.81 FGFR1 (0.41) FGFR3KDRFGFR1FGFR2FGFR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9133219-B2 Bicyclic antibiotics BASILEA PHARMACEUTICA AG (CH) 2015-09-15 US claimed
US-20150080373-A1 NOVEL BICYCLIC ANTIBIOTICS Basiliea Pharmaceutica AG 2015-03-19 US claimed
US-8927542-B2 Bicyclic antibiotics BASILEA PHARMACEUTICA AG (CH) 2015-01-06 US claimed
US-20140221348-A1 NOVEL BICYCLIC ANTIBIOTICS BASILEA PHARMACEUTICA AG (CH) 2014-08-07 US claimed
US-8716280-B2 Bicyclic antibiotics BASILEA PHARMACEUTICA AG (CH) 2014-05-06 US claimed
US-9133219-B2 Bicyclic antibiotics BASILEA PHARMACEUTICA AG (CH) 2015-09-15 US disclosed
US-20150080373-A1 NOVEL BICYCLIC ANTIBIOTICS Basiliea Pharmaceutica AG 2015-03-19 US disclosed
US-8927542-B2 Bicyclic antibiotics BASILEA PHARMACEUTICA AG (CH) 2015-01-06 US disclosed
US-20140221348-A1 NOVEL BICYCLIC ANTIBIOTICS BASILEA PHARMACEUTICA AG (CH) 2014-08-07 US disclosed
US-8716280-B2 Bicyclic antibiotics BASILEA PHARMACEUTICA AG (CH) 2014-05-06 US disclosed
US-20120040957-A1 Novel Bicyclic Antibiotics BASILEA PHARMACEUTICA AG 2012-02-16 US disclosed
EP-2389376-A1 NOVEL BICYCLIC ANTIBIOTICS Basilea Pharmaceutica AG (CH) 2011-11-30 EP disclosed
WO-2010084152-A1 NOVEL BICYCLIC ANTIBIOTICS BASILEA PHARMACEUTICA AG (CH) 2010-07-29 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 (3 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-20120040957-A1 Novel Bicyclic Antibiotics C5, C1S, CBR3 FGFR3 1875/4885KDR 4865/4885FGFR1 2858/4885
US-20140221348-A1 NOVEL BICYCLIC ANTIBIOTICS C1S, XPA, XDH FGFR3 1971/4885KDR 4862/4885FGFR1 2650/4885
US-20150080373-A1 NOVEL BICYCLIC ANTIBIOTICS C1S, XPA, XDH FGFR3 1971/4885KDR 4862/4885FGFR1 2650/4885

“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.