SCHEMBL20600930

SCHEMBL20600930

O=C(N[C@H](C1CCNCC1)C1CC1)c1ccc(Cl)s1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.48
F2 P00734 1/20 0.42
RAB9A P51151 6/20 0.41
KMT2A Q03164 5/20 0.41
MEN1 O00255 3/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
MAPK1 P28482 3/20 0.40
LMNA P02545 2/20 0.40
NPC1 O15118 5/20 0.40
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 3/20 0.40
NFKB1 P19838 2/20 0.40
NFKB2 Q00653 2/20 0.40
RELA Q04206 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
TP53 P04637 2/20 0.40
MAPT P10636 2/20 0.40
CASP1 P29466 1/20 0.40

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
SCHEMBL20600951 1.00 SMN1; SMN2 (0.48) SMN1; SMN2F2RAB9AKMT2AMEN1
SCHEMBL20600933 1.00 SMN1; SMN2 (0.48) SMN1; SMN2F2RAB9AKMT2AMEN1
SCHEMBL20600906 0.85 SMN1; SMN2 (0.59) SMN1; SMN2F2RAB9AKMT2AMEN1
SCHEMBL20600905 0.85 SMN1; SMN2 (0.59) SMN1; SMN2F2RAB9AKMT2AMEN1
SCHEMBL20600952 0.85 SMN1; SMN2 (0.59) SMN1; SMN2F2RAB9AKMT2AMEN1
SCHEMBL20615697 0.82 SMN1; SMN2 (0.47) SMN1; SMN2F2RAB9AKMT2AMEN1
SCHEMBL20601154 0.81 SMYD3 (0.56) SMN1; SMN2
SCHEMBL20601550 0.81 SMN1; SMN2 (0.44) SMN1; SMN2F2RAB9AKMT2AMEN1
SCHEMBL20601151 0.81 SMYD3 (0.56) SMN1; SMN2
SCHEMBL20600908 0.81 SMN1; SMN2 (0.46) SMN1; SMN2F2RAB9AKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10927078-B2 Modulators of indoleamine 2,3-dioxygenase GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-02-23 US disclosed
US-10927078-B2 Modulators of indoleamine 2,3-dioxygenase GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-02-23 US disclosed
US-20200165201-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-05-28 US disclosed
US-20200165201-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-05-28 US disclosed
EP-3645520-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE GlaxoSmithKline Intellectual Property Development Limited (GB) 2020-05-06 EP disclosed
CN-110709391-A Modulators of indoleamine2, 3-dioxygenase 葛兰素史克知识产权开发有限公司 2020-01-17 CN disclosed
WO-2019003141-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-01-03 WO disclosed
WO-2019003141-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-01-03 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 (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-20200165201-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE IDO1, IDO2, TPH1 SMN1; SMN2 2957/4885F2 3638/4885RAB9A 3849/4885
US-10927078-B2 Modulators of indoleamine 2,3-dioxygenase IDO1, IDO2, TPH1 SMN1; SMN2 2957/4885F2 3638/4885RAB9A 3849/4885

“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.