SCHEMBL4334784

SCHEMBL4334784

Cc1ccc(-n2ccc(=O)[nH]2)cc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.53
ALDH1A1 P00352 7/20 0.45
HPGD P15428 1/20 0.45
ALKBH5 Q6P6C2 1/20 0.44
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
HCAR1 Q9BXC0 1/20 0.43
ADRB1 P08588 1/20 0.41
GAA P10253 3/20 0.39
MAPT P10636 3/20 0.39
LMNA P02545 2/20 0.39
NPSR1 Q6W5P4 3/20 0.38
TSHR P16473 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MAPK1 P28482 1/20 0.38
CASP1 P29466 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
HTT P42858 1/20 0.36

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
SCHEMBL15717334 0.84 SMN1; SMN2 (0.49) SMN1; SMN2ALDH1A1HPGDALKBH5KMT2A
SCHEMBL11132659 0.79 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1HPGDHCAR1ADRB1
SCHEMBL30278629 0.74 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1KMT2AMEN1ADRB1
SCHEMBL25565822 0.74 CRBN (0.56) SMN1; SMN2ALDH1A1HPGDALKBH5KMT2A
SCHEMBL482570 0.71 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1HPGDALKBH5KMT2A
SCHEMBL6986315 0.71 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1HPGDALKBH5KMT2A
SCHEMBL481991 0.70 SMN1; SMN2 (0.63) SMN1; SMN2ALDH1A1HPGDKMT2AMEN1
SCHEMBL29401773 0.70 ALKBH5 (0.51) SMN1; SMN2ALDH1A1HPGDALKBH5KMT2A
SCHEMBL482140 0.70 SMN1; SMN2 (1.00) SMN1; SMN2KMT2AMEN1GAALMNA
SCHEMBL8088493 0.68 SMN1; SMN2 (0.55) SMN1; SMN2ALDH1A1HPGDKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130078213-A1 THROMBOPOIETIN MIMETICS GLAXOSMITHKLINE LLC 2013-03-28 US disclosed
EP-1889838-B1 Thrombopoietin mimetics SMITHKLINE BEECHAM CORP (US) 2009-10-14 EP disclosed
EP-1889838-A1 Thrombopoietin mimetics SmithKline Beecham Corporation (US) 2008-02-20 EP disclosed
EP-1864981-A1 Thrombopoietin mimetics SmithKline Beecham Corporation (US) 2007-12-12 EP disclosed
US-20070129338-A1 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORPORATION 2007-06-07 US disclosed
US-20040019190-A1 Thrombopoietin mimetics NOVARTIS AG (CH) 2004-01-29 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 (2 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-20070129338-A1 THROMBOPOIETIN MIMETICS MPL, THPO, TEK SMN1; SMN2 2310/4885ALDH1A1 1012/4885HPGD 1200/4885
US-20130078213-A1 THROMBOPOIETIN MIMETICS MPL, THPO, TEK SMN1; SMN2 2310/4885ALDH1A1 1012/4885HPGD 1200/4885

“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.