SCHEMBL29664407

SCHEMBL29664407

Cc1cccc2cccnc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 4/20 0.61
CCR8 P51685 4/20 0.61
KDM4E B2RXH2 4/20 0.61
MAPT P10636 4/20 0.61
CCR5 P51681 3/20 0.61
LMNA P02545 2/20 0.61
MMP2 P08253 2/20 0.61
TSHR P16473 2/20 0.61
HSP90AA1 P07900 2/20 0.61
ALOX15 P16050 2/20 0.61
HTT P42858 2/20 0.61
GMNN O75496 1/20 0.61
TP53 P04637 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2D6 P10635 1/20 0.61
MMP9 P14780 1/20 0.61
NFKB1 P19838 1/20 0.61
MMP8 P22894 1/20 0.61
THPO P40225 1/20 0.61
MTOR P42345 1/20 0.61

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
SCHEMBL256942 1.00 CCR1 (0.61) CCR1CCR8KDM4EMAPTCCR5
SCHEMBL30150752 0.98 LMNA (0.59) CCR1CCR8KDM4EMAPTCCR5
Ammonia Solution, Strong SCHEMBL28014320 0.98 LMNA (0.59) CCR1CCR8KDM4EMAPTCCR5
Bicarbonate SCHEMBL9198375 0.90 PARP1 (0.53) CCR1CCR8KDM4EMAPTCCR5
Quinoline SCHEMBL28253161 0.88 ALDH1A1 (0.63) CCR1CCR8KDM4EMAPTCCR5
Isothiocyanate SCHEMBL27404432 0.88 LMNA (0.50) CCR1CCR8KDM4EMAPTCCR5
SCHEMBL7745077 0.88 LMNA (0.55) CCR1CCR8KDM4EMAPTCCR5
SCHEMBL27975277 0.88 SLC40A1 (0.54) CCR1CCR8KDM4EMAPTCCR5
SCHEMBL10525606 0.88 LMNA (0.50) CCR1CCR8KDM4EMAPTCCR5
SCHEMBL9400641 0.87 KDR (0.50) CCR1CCR8KDM4EMAPTCCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025068943-A1 KAT6 INHIBITORS BEIGENE SWITZERLAND GMBH (CH) 2025-04-03 WO disclosed
EP-4055013-A1 WDR5 INHIBITORS AND MODULATORS Vanderbilt University (US) 2022-09-14 EP disclosed
WO-2022125736-A1 A TAUTOMERIC LIGAND ENABLES BIOMIMETIC C-H HYDROXYLATION WITH MOLECULAR OXYGEN THE SCRIPPS RESEARCH INSTITUTE (US) 2022-06-16 WO disclosed