SCHEMBL179288

SCHEMBL179288

CCN(CC)c1ccc(C)cn1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.62
CCR1 P32246 1/20 0.44
CCR5 P51681 1/20 0.44
CCR8 P51685 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
MYC P01106 10/20 0.43
AOC3 Q16853 1/20 0.42
NOS3 P29474 1/20 0.41
NOS2 P35228 1/20 0.41
HCAR3 P49019 1/20 0.40
TDP1 Q9NUW8 1/20 0.36
KDM4E B2RXH2 1/20 0.36
KMT2A Q03164 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
SCHEMBL23183031 0.88 GBA1 (0.50) GBA1CCR1CCR5CCR8HDAC6
SCHEMBL21388440 0.88 HCAR3 (0.50) GBA1CCR1CCR5CCR8HDAC6
SCHEMBL11567147 0.85 GBA1 (0.47) GBA1AOC3KMT2A
SCHEMBL20056973 0.83 HCAR3 (0.57) GBA1CCR1CCR5CCR8HDAC6
SCHEMBL21241060 0.82 GBA1 (0.45) GBA1CCR1CCR5CCR8HDAC6
SCHEMBL18937028 0.82 GBA1 (0.45) GBA1CCR1CCR5CCR8HDAC6
SCHEMBL8278724 0.81 CCR1 (0.48) GBA1CCR1CCR5CCR8HDAC6
SCHEMBL12394221 0.80 HCAR3 (0.46) GBA1CCR1CCR5CCR8HDAC6
SCHEMBL11567387 0.80 GBA1 (0.48) GBA1KDM4EKMT2A
SCHEMBL19417994 0.79 NOS3 (0.43) GBA1CCR1CCR5CCR8HDAC6

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 134 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230364097-A1 TREATMENT OF CANCERS USING PI3 KINASE ISOFORM MODULATORS INFINITY PHARMACEUTICALS, INC. (US) 2023-11-16 US disclosed
US-11771738-B2 Endoparasitic depsipeptides ZOETIS SERVICES LLC (US) 2023-10-03 US disclosed
US-11771738-B2 Endoparasitic depsipeptides ZOETIS SERVICES LLC (US) 2023-10-03 US disclosed
US-20230233560-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-07-27 US disclosed
EP-3436446-B1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMA (US) 2023-06-07 EP disclosed
US-20230125712-A1 SELF-LUMINOUS DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2023-04-27 US disclosed
EP-4066834-A1 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF PI3K-GAMMA MEDIATED DISORDERS Infinity Pharmaceuticals, Inc. (US) 2022-10-05 EP disclosed
EP-3305778-B1 INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LTD (GB) 2022-01-19 EP disclosed
EP-3441392-B1 A PHARMACEUTICAL COMPOSITION FOR ORAL ADMINISTRATION INTELLIKINE LLC (US) 2021-12-15 EP disclosed
EP-3811974-A1 TREATMENT OF CANCERS USING PI3 KINASE ISOFORM MODULATORS Infinity Pharmaceuticals, Inc. (US) 2021-04-28 EP disclosed
US-20110160232-A1 CERTAIN CHEMICAL ENTITIES AND THERAPEUTIC USES THEREOF INTELLIKINE LLC 2011-06-30 US disclosed
US-20110160232-A1 CERTAIN CHEMICAL ENTITIES AND THERAPEUTIC USES THEREOF INTELLIKINE LLC 2011-06-30 US disclosed
WO-2011008302-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS INTELLIKINE, INC. (US) 2011-01-20 WO disclosed
WO-2010043000-A1 S1P RECEPTORS MODULATORS AND THEIR USE THEREOF AKAAL PHARMA PTY LTD (AU) 2010-04-22 WO disclosed
WO-2009088990-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS INTELLIKINE, INC. (US) 2009-07-16 WO disclosed
WO-2009046448-A1 CHEMICAL ENTITIES AND THERAPEUTIC USES THEREOF INTELLIKINE, INC. (US) 2009-04-09 WO disclosed
EP-0569701-B1 Process for preparation of 2-amino-5-methyl-pyridine BAYER AG (DE) 2000-09-27 EP disclosed
US-5463065-A Process for the preparation of 2-amino-5-methyl-pyridine BAYER AKTIENGESELLSCHAFT (DE) 1995-10-31 US disclosed
US-5332824-A Process for the preparation of 2-amino-5-methyl-pyridine BAYER AKTIENGESELLSCHAFT (DE) 1994-07-26 US disclosed
EP-0569701-A1 Process for preparation of 2-amino-5-methyl-pyridine BAYER AG (DE) 1993-11-18 EP 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 (4 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-20230233560-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1B, SLC26A4 GBA1 1541/4885CCR1 1199/4885CCR5 594/4885
US-11771738-B2 Endoparasitic depsipeptides VIP, PREP, VIPR1 GBA1 381/4885CCR1 692/4885CCR5 1684/4885
US-20110160232-A1 CERTAIN CHEMICAL ENTITIES AND THERAPEUTIC USES THEREOF PIK3CA, PIK3C3, PRKACA GBA1 702/4885CCR1 3756/4885CCR5 4437/4885
US-20230364097-A1 TREATMENT OF CANCERS USING PI3 KINASE ISOFORM MODULATORS PIK3CA, MCL1, PIK3CB GBA1 3052/4885CCR1 2706/4885CCR5 2780/4885

“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.