SCHEMBL3144005

SCHEMBL3144005

Cc1ccc(-c2cc3cc(CN4CCN(CCO)CC4)ccc3n2C(=O)OC(C)(C)C)c2c1CNC2=O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 9/20 0.38
KDR P35968 3/20 0.37
PDGFRB P09619 2/20 0.37
PKM P14618 1/20 0.35
ATR Q13535 2/20 0.35
ATRIP Q8WXE1 2/20 0.35
NSD2 O96028 1/20 0.34
NR1H3 Q13133 3/20 0.34
IDO1 P14902 1/20 0.34
TDO2 P48775 1/20 0.34
IDO2 Q6ZQW0 1/20 0.34
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33
SUCNR1 Q9BXA5 1/20 0.33
TBK1 Q9UHD2 1/20 0.32

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
SCHEMBL3043824 0.93 NR1H2 (0.38) NR1H2KDRPDGFRBPKMATR
SCHEMBL3054418 0.92 NR1H2 (0.37) NR1H2KDRPDGFRBPKMATR
SCHEMBL3166857 0.92 NR1H2 (0.37) NR1H2KDRPDGFRBPKMATR
SCHEMBL3039052 0.91 NR1H2 (0.37) NR1H2KDRPDGFRBATRATRIP
SCHEMBL3151702 0.91 NR1H2 (0.37) NR1H2KDRPDGFRBPKMATR
SCHEMBL3155324 0.90 NR1H2 (0.36) NR1H2KDRPDGFRBPKMATR
SCHEMBL3153122 0.89 NR1H2 (0.35) NR1H2KDRPKMATRATRIP
SCHEMBL3137975 0.88 NR1H2 (0.37) NR1H2KDRPDGFRBPKMATR
SCHEMBL3042659 0.88 NR1H2 (0.36) NR1H2KDRPDGFRBPKMATR
SCHEMBL3155438 0.87 NR1H2 (0.36) NR1H2KDRPDGFRBPKMATR

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-7745641-B2 Nitrogen-containing heterocyclic compound KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-06-29 US disclosed
US-20090054407-A1 Nitrogen-containing heterocyclic compound KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-02-26 US disclosed
EP-1880993-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND KYOWA HAKKO KOGYO CO., LTD. (JP) 2008-01-23 EP 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-20090054407-A1 Nitrogen-containing heterocyclic compound NR4A1, NR5A2, PRMT8 NR1H2 21/4885KDR 3226/4885PDGFRB 4190/4885

“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.