SCHEMBL4044217

SCHEMBL4044217

NC(=O)c1c(Cl)c(-c2ccccc2)n2c1C(S(=O)(=O)c1ccccc1)NCC2

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 1/20 0.34
▸ PIM2 Q9P1W9 1/20 0.34
▸ SPR P35270 1/20 0.32
▸ HTR2A P28223 2/20 0.32
▸ HTR2C P28335 1/20 0.32
▸ CSNK1E P49674 4/20 0.31
▸ PARP1 P09874 1/20 0.31
▸ IKBKB O14920 1/20 0.30
▸ CHUK O15111 1/20 0.30

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
SCHEMBL4036267 0.75 CSNK1E (0.36) PIM1PIM2HTR2AHTR2CCSNK1E
SCHEMBL4044206 0.68 KMT2A (0.42) CSNK1E
Trifluoroacetic Acid SCHEMBL4036264 0.65 HTR2A (0.40) PIM1PIM2HTR2AHTR2CCSNK1E
SCHEMBL4043222 0.64 GBA1 (0.42) IKBKBCHUK
SCHEMBL4040943 0.63 GBA1 (0.43) CSNK1E
SCHEMBL4036903 0.63 CSNK1E (0.42) CSNK1E
SCHEMBL4047940 0.62 LSS (0.37) CSNK1E
SCHEMBL4041961 0.62 PKM (0.47) —
SCHEMBL4036996 0.62 SMN1; SMN2 (0.39) CSNK1EIKBKBCHUK
SCHEMBL4043718 0.62 CSNK1E (0.41) CSNK1E

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
EP-1436291-B1 INDOLIZINES AS KINASE PROTEIN INHIBITORS AVENTIS PHARMA SA (FR) 2009-01-14 — — EP disclosed
US-20070238734-A1 JNK INHIBITORS SANOLI-AVENTIS (FR) 2007-10-11 — — US disclosed
US-7148215-B2 Prodrugs as antihistamines or anticarcinogenic agents AVENTIS PHARMA S.A. (FR) 2006-12-12 — — US disclosed
US-20050009831-A1 Pyrrolo[1,2-a]pyrazine-8-carboxamides are JNK inhibitors, useful as anticarcinogenic agents AVENTIS PHARMA S.A, (FR) 2005-01-13 — — US disclosed
EP-1436291-A2 INDOLIZINES AS KINASE PROTEIN INHIBITORS Aventis Pharma S.A. (FR) 2004-07-14 — — EP disclosed
WO-2003024967-A2 INDOLIZINES AS KINASE PROTEIN INHIBITORS AVENTIS PHARMA S.A. (FR) 2003-03-27 — — 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-20070238734-A1 JNK INHIBITORS MAP3K7, MAPKAPK2, MAPK7 PIM1 185/4885PIM2 216/4885SPR 2644/4885
US-20050009831-A1 Pyrrolo[1,2-a]pyrazine-8-carboxamides are JNK inhibitors, useful as anticarcinogenic agents CNKSR1, ROS1, NRAS PIM1 1102/4885PIM2 1184/4885SPR 4138/4885

“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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