SCHEMBL24176138

SCHEMBL24176138

Cc1c(NC[C@H]2CCC[C@@H](c3ccc(Cl)cc3)O2)ncnc1C(=O)N1CCC(N)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 4/20 0.46
CCR5 P51681 2/20 0.46
PAK1 Q13153 1/20 0.35
NPC1 O15118 2/20 0.35
HPGD P15428 2/20 0.35
RAB9A P51151 2/20 0.35
HSD17B10 Q99714 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
STAT1 P42224 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 2/20 0.34
TNK2 Q07912 3/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33

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
SCHEMBL24176498 1.00 CCR2 (0.46) CCR2CCR5PAK1NPC1HPGD
SCHEMBL24176496 0.93 CCR2 (0.47) CCR2CCR5PAK1HPGDTNK2
SCHEMBL18924971 0.93 CCR2 (0.47) CCR2CCR5PAK1HPGDTNK2
SCHEMBL24176345 0.90 CCR2 (0.58) CCR2CCR5PAK1RPS6KB1
SCHEMBL21422799 0.88 CCR2 (0.48) CCR2CCR5
SCHEMBL24176080 0.88 CCR2 (0.48) CCR2CCR5
SCHEMBL24176087 0.87 CCR2 (0.48) CCR2CCR5TNK2SLC6A2SLC6A4
SCHEMBL20039984 0.85 CCR2 (0.46) CCR2CCR5PAK1HPGDHSD17B10
SCHEMBL3055916 0.85 CCR2 (0.40) CCR2CCR5NPC1HPGDRAB9A
SCHEMBL3058066 0.85 CCR2 (0.40) CCR2CCR5NPC1HPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11731981-B2 CCR2 receptor antagonists and uses thereof CENTREXION THERAPEUTICS CORPORATION (US) 2023-08-22 US disclosed
US-20220002310-A1 CCR2 RECEPTOR ANTAGONISTS AND USES THEREOF ANKURA TRUST COMPANY, LLC, AS ADMINISTRATIVE AND COLLATERAL AGENT 2022-01-06 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-11731981-B2 CCR2 receptor antagonists and uses thereof CCR2, CCRL2, CCR1 CCR2 1/4885CCR5 5/4885PAK1 938/4885
US-20220002310-A1 CCR2 RECEPTOR ANTAGONISTS AND USES THEREOF CCR2, CCRL2, CCR1 CCR2 1/4885CCR5 5/4885PAK1 938/4885

“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.