SCHEMBL24549320

SCHEMBL24549320

Clc1ccc2c(c1)nc(Cl)n2Cc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.61
ALDH1A1 P00352 5/20 0.57
KDM4E B2RXH2 2/20 0.57
KMT2A Q03164 1/20 0.57
HTT P42858 2/20 0.56
ALOX5AP P20292 1/20 0.55
POLB P06746 2/20 0.51
CFTR P13569 1/20 0.51
LMNA P02545 1/20 0.50
TP53 P04637 1/20 0.49
DRD2 P14416 1/20 0.48
TBXA2R P21731 1/20 0.48
TNF P01375 2/20 0.48
CXCL8 P10145 1/20 0.48
SOS1 Q07889 1/20 0.48
NOD2 Q9HC29 1/20 0.48
NOD1 Q9Y239 1/20 0.48
GALR3 O60755 1/20 0.48
NR2F2 P24468 1/20 0.48
RAB9A P51151 1/20 0.48

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
SCHEMBL12771510 0.84 TNF (0.69) TDP1ALDH1A1KDM4EKMT2AHTT
SCHEMBL7436459 0.84 TBXA2R (0.52) TDP1ALDH1A1HTTPOLBLMNA
SCHEMBL1169953 0.83 LMNA (0.70) ALDH1A1KDM4EKMT2AHTTCFTR
SCHEMBL8185055 0.82 DCTPP1 (0.50) TDP1ALDH1A1KDM4EKMT2AHTT
SCHEMBL4083319 0.81 TP53 (0.63) ALDH1A1KMT2ALMNATP53TNF
SCHEMBL22465204 0.81 TBXA2R (0.52) TDP1ALDH1A1KDM4EKMT2AHTT
SCHEMBL4097969 0.80 NOD1 (0.71) TDP1ALDH1A1KDM4EKMT2ALMNA
SCHEMBL27398016 0.79 SOS1 (0.59) ALDH1A1KMT2AHTTLMNATP53
SCHEMBL22955866 0.77 KMT2A (0.66) TDP1ALDH1A1KDM4EKMT2AHTT
SCHEMBL29808487 0.77 KMT2A (0.66) TDP1ALDH1A1KDM4EKMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022133098-A2 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2022-06-23 WO disclosed