SCHEMBL15096078

SCHEMBL15096078

Cc1cc(N2CCN(C(=O)Cn3nc(-c4ncc[nH]4)c4c(N)ncnc43)[C@@H](C)C2)ccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 6/20 0.46
CXCR3 P49682 4/20 0.38
TGFBR1 P36897 5/20 0.37
LIMK2 P53671 2/20 0.37
PIK3CD O00329 3/20 0.36
ABL1 P00519 3/20 0.36
EGFR P00533 3/20 0.36
HCK P08631 3/20 0.36
SRC P12931 3/20 0.36
KDR P35968 3/20 0.36
PIK3CA P42336 3/20 0.36
PIK3CB P42338 3/20 0.36
MTOR P42345 3/20 0.36
PIK3CG P48736 3/20 0.36
EPHB4 P54760 3/20 0.36
PRKDC P78527 3/20 0.36
PI4KB Q9UBF8 3/20 0.36
KCNH2 Q12809 2/20 0.35

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
SCHEMBL26188303 0.93 CCR1 (0.47) CCR1CXCR3LIMK2KCNH2
SCHEMBL3223541 0.91 CCR1 (0.57) CCR1KCNH2
SCHEMBL3232495 0.91 CCR1 (0.57) CCR1KCNH2
SCHEMBL3224268 0.90 CCR1 (0.42) CCR1CXCR3TGFBR1LIMK2ABL1
SCHEMBL3225299 0.90 CCR1 (0.42) CCR1CXCR3TGFBR1LIMK2ABL1
SCHEMBL3232577 0.90 CCR1 (0.50) CCR1CXCR3TGFBR1PIK3CDABL1
SCHEMBL3234396 0.90 CCR1 (0.50) CCR1CXCR3TGFBR1PIK3CDABL1
SCHEMBL16519768 0.90 CCR1 (0.44) CCR1CXCR3TGFBR1PIK3CDABL1
SCHEMBL15096079 0.88 CCR1 (0.58) CCR1TGFBR1KCNH2
SCHEMBL15096077 0.87 CCR1 (0.37) CCR1CXCR3TGFBR1LIMK2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11744822-B2 Reducing tumor burden by administering CCR1 antagonists in combination with PD-1 inhibitors or PD-L1 inhibitors CHEMOCENTRYX, INC. (US) 2023-09-05 US disclosed
US-20170290808-A1 REDUCING TUMOR BURDEN BY ADMINISTERING CCR1 ANTAGONISTS IN COMBINATION WITH PD-1 INHIBITORS OR PD-L1 INHIBITORS CHEMOCENTRYX, INC. 2017-10-12 US disclosed
US-8946240-B2 4-amino-3-(imidazolyl)-pyrazolo[3,4-D]pyrimidines CHEMOCENTRYX, INC. (US) 2015-02-03 US disclosed
US-20130178623-A1 4-AMINO-3-(IMIDAZOLYL)-PYRAZOLO[3,4-D]PYRIMIDINES CHEMOCENTRYX, INC. (US) 2013-07-11 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 (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-20170290808-A1 REDUCING TUMOR BURDEN BY ADMINISTERING CCR1 ANTAGONISTS IN COMBINATION WITH PD-1 INHIBITORS OR PD-L1 INHIBITORS CCR1, CCRL2, CCR3 CCR1 1/4885CXCR3 9/4885TGFBR1 175/4885
US-11744822-B2 Reducing tumor burden by administering CCR1 antagonists in combination with PD-1 inhibitors or PD-L1 inhibitors CCR1, CCRL2, CCR3 CCR1 1/4885CXCR3 9/4885TGFBR1 175/4885
US-20130178623-A1 4-AMINO-3-(IMIDAZOLYL)-PYRAZOLO[3,4-D]PYRIMIDINES CCR1, CCR3, CCR4 CCR1 1/4885CXCR3 11/4885TGFBR1 595/4885

“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.