SCHEMBL8944345

SCHEMBL8944345

ClCc1ccc2ccc3ccc(CCl)nc3c2n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 5/20 0.56
CCR5 P51681 2/20 0.38
RAB9A P51151 1/20 0.38
PDE10A Q9Y233 1/20 0.33
PARP1 P09874 1/20 0.32
GFER P55789 1/20 0.32
TDP1 Q9NUW8 2/20 0.31
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
KDM4E B2RXH2 1/20 0.31
GMNN O75496 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MMP2 P08253 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31
MMP9 P14780 1/20 0.31

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
SCHEMBL31648790 1.00 CCR1 (0.56) CCR1CCR5RAB9APDE10APARP1
SCHEMBL8944463 0.87 CCR1 (0.62) CCR1CCR5RAB9APARP1SMN1; SMN2
SCHEMBL8181932 0.80 CCR1 (0.39) CCR1CCR5RAB9APARP1TDP1
SCHEMBL9018925 0.80 FAAH (0.43) CCR1RAB9APDE10APARP1TDP1
SCHEMBL2781605 0.79 METAP2 (0.53) CCR1RAB9APDE10ATDP1ALDH1A1
SCHEMBL9018899 0.79 PDE10A (0.44) CCR1RAB9APDE10APARP1TDP1
SCHEMBL4851483 0.79 AR (0.41) CCR1PDE10APARP1TDP1ALDH1A1
Hydrochloric Acid SCHEMBL6535609 0.77 METAP2 (0.52) CCR1RAB9APDE10ATDP1ALDH1A1
SCHEMBL8944329 0.76 CCR1 (0.40) CCR1CCR5RAB9APDE10ATDP1
SCHEMBL1498734 0.75 CCR1 (0.34) CCR1CCR5PARP1TDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5545639-A USING 2,9-BIS(HALOMETHYL)-1,10-PHENANTHROLINE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1996-08-13 US claimed
WO-2025133654-A1 NEW CRYPTATE-TYPE (BICYCLIC) CHELATORS AND THEIR USE AS LIGANDS FOR MN(II)-BASED MRI CONTRAST AGENTS, 52MN-BASED PET DIAGNOSTIC AGENTS, AND 64/67CU(II)-ISOTOPE-BASED PET DIAGNOSTIC AND THERAPEUTIC AGENTS DEBRECENI EGYETEM (HU) 2025-06-26 WO disclosed
US-11209421-B2 Cytidine deaminase expression level in cancer as a new therapeutic target CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2021-12-28 US disclosed
US-20190293629-A1 CYTIDINE DEAMINASE EXPRESSION LEVEL IN CANCER AS A NEW THERAPEUTIC TARGET CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2019-09-26 US disclosed
US-5545639-A USING 2,9-BIS(HALOMETHYL)-1,10-PHENANTHROLINE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1996-08-13 US disclosed