SCHEMBL15515608

SCHEMBL15515608

NC(=O)c1cc2ccccc2n1N1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PLA2G10 O15496 8/20 0.45
▸ CCR2 P41597 1/20 0.42
▸ DAO P14920 1/20 0.41
▸ SLC9A1 P19634 1/20 0.41
▸ MCL1 Q07820 1/20 0.41
▸ F10 P00742 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ SRC P12931 1/20 0.39
▸ HPGD P15428 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ SIGMAR1 Q99720 2/20 0.38
▸ GAA P10253 1/20 0.38

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
SCHEMBL16821942 0.85 CCR2 (0.43) PLA2G10CCR2DAOSLC9A1MCL1
SCHEMBL7079238 0.84 DAO (0.56) PLA2G10CCR2DAOMCL1ALDH1A1
SCHEMBL23111895 0.83 CCR2 (0.41) PLA2G10CCR2DAOSLC9A1MCL1
SCHEMBL30556365 0.83 CCR2 (0.41) PLA2G10CCR2DAOSLC9A1MCL1
SCHEMBL7078849 0.78 GAA (0.49) PLA2G10SIGMAR1GAA
SCHEMBL2830160 0.73 PLA2G10 (0.54) PLA2G10CCR2DAOSLC9A1MCL1
SCHEMBL5167054 0.72 CCR2 (0.38) PLA2G10CCR2SLC9A1F10ALDH1A1
SCHEMBL4103400 0.72 PLA2G10 (0.53) PLA2G10CCR2DAOSLC9A1MCL1
SCHEMBL7670332 0.72 DAO (0.70) PLA2G10CCR2DAOSLC9A1MCL1
Hydrochloric Acid SCHEMBL27784064 0.72 PLA2G10 (0.53) PLA2G10CCR2DAOSLC9A1MCL1

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-20210032202-A1 INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF NOVARTIS INSTITUTE FOR TROPICAL DISEASES PTE LTD. (SG) 2021-02-04 — — US disclosed
US-20160355477-A1 INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2016-12-08 — — US disclosed
US-9447039-B2 Indole carboxamide derivatives and uses thereof NOVARTIS AG (CH) 2016-09-20 — — US disclosed
EP-2892880-A1 INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF Novartis AG (CH) 2015-07-15 — — EP disclosed
US-20150175539-A1 INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2015-06-25 — — US disclosed
WO-2014037900-A1 INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2014-03-13 — — 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-20150175539-A1 INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF TPH1, TPH2, IARS2 PLA2G10 2335/4885CCR2 1055/4885DAO 1198/4885
US-20210032202-A1 INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF TPH1, TPH2, IARS2 PLA2G10 2394/4885CCR2 1020/4885DAO 1322/4885
US-20160355477-A1 INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF TPH1, TPH2, IARS2 PLA2G10 2335/4885CCR2 1055/4885DAO 1198/4885

“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.

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