SCHEMBL4714519

SCHEMBL4714519

O=C(c1ccccc1)n1ccc2ncccc21

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 2/20 0.66
MET P08581 3/20 0.59
RAB9A P51151 3/20 0.58
TSHR P16473 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
KMT2A Q03164 5/20 0.50
NPC1 O15118 2/20 0.45
MEN1 O00255 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HPGD P15428 2/20 0.45
RPS6KA5 O75582 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MGAM O43451 1/20 0.44
F2 P00734 1/20 0.44
AMY1A P0DUB6 1/20 0.44
GAA P10253 1/20 0.44
SI P14410 1/20 0.44
SLC9A1 P19634 1/20 0.44

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
SCHEMBL30241905 0.83 SLC22A12 (0.56) SLC22A12METSMN1; SMN2RPS6KA5
SCHEMBL288413 0.83 SLC22A12 (0.56) SLC22A12METSMN1; SMN2RPS6KA5
SCHEMBL30532842 0.81 SLC22A12 (0.55) SLC22A12METSMN1; SMN2RPS6KA5
SCHEMBL28857691 0.80 SLC22A12 (1.00) SLC22A12METKMT2ARPS6KA5
SCHEMBL29898292 0.80 SLC22A12 (1.00) SLC22A12METKMT2ARPS6KA5
SCHEMBL14312991 0.78 PARP1 (0.56) SLC22A12METRPS6KA5
SCHEMBL31200457 0.78 SLC22A12 (0.55) SLC22A12METRPS6KA5
SCHEMBL3477048 0.78 KMT2A (0.77) RAB9ATSHRL3MBTL1KMT2ANPC1
SCHEMBL383515 0.75 SLC22A12 (0.58) SLC22A12METKMT2AMEN1
SCHEMBL27923545 0.74 SLC22A12 (0.78) SLC22A12RAB9ATSHRL3MBTL1

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-7456286-B2 Bicyclic heteroaromatic compounds as kinase inhibitors UCB PHARMA, S.A. (BE) 2008-11-25 US disclosed
EP-1549648-B1 BICYCLIC HETEROAROMATIC COMPOUNDS AS KINASE INHIBITORS UCB PHARMA SA (BE) 2008-11-12 EP disclosed
US-20060122212-A1 Bicyclic heteroaromatic compounds as kinase inhibitors CELLTECH R&D LIMITED (GB) 2006-06-08 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-20060122212-A1 Bicyclic heteroaromatic compounds as kinase inhibitors MAP2K2, MAP2K7, MAP2K3 SLC22A12 4560/4885MET 2070/4885RAB9A 2689/4885

“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.