SCHEMBL29138237

SCHEMBL29138237

Cc1ccc(Br)cc1C(=O)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.54
TDP1 Q9NUW8 4/20 0.53
L3MBTL1 Q9Y468 4/20 0.50
TSHR P16473 3/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A3 Q01959 1/20 0.50
KMT2A Q03164 1/20 0.50
CYP3A4 P08684 1/20 0.50
MAPK1 P28482 1/20 0.50
LMNA P02545 2/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
GPBAR1 Q8TDU6 1/20 0.46
LRRK2 Q5S007 1/20 0.46
PTGES O14684 1/20 0.46
RAB9A P51151 2/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46

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
SCHEMBL30806015 1.00 ALDH1A1 (0.54) ALDH1A1TDP1L3MBTL1TSHRSLC6A2
SCHEMBL3950165 0.88 ALDH1A1 (0.54) ALDH1A1TDP1L3MBTL1TSHRSLC6A2
SCHEMBL18717240 0.85 TDP1 (0.59) ALDH1A1TDP1L3MBTL1TSHRSLC6A2
SCHEMBL21140739 0.82 ALDH1A1 (0.54) ALDH1A1TDP1L3MBTL1TSHRSLC6A2
SCHEMBL20831012 0.82 ALDH1A1 (0.55) ALDH1A1TDP1L3MBTL1TSHRSLC6A2
SCHEMBL20831006 0.82 ALDH1A1 (0.54) ALDH1A1TDP1L3MBTL1TSHRSLC6A2
SCHEMBL31737536 0.82 ALDH1A1 (0.54) ALDH1A1TDP1L3MBTL1TSHRSLC6A2
SCHEMBL20830626 0.82 ALDH1A1 (0.54) ALDH1A1TDP1L3MBTL1TSHRSLC6A2
SCHEMBL6159701 0.82 ALDH1A1 (0.54) ALDH1A1TDP1L3MBTL1TSHRSLC6A2
SCHEMBL31189998 0.82 POLB (0.56) ALDH1A1TDP1L3MBTL1TSHRSLC6A2

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
CN-119866328-A Antiviral compounds 英菲克斯治疗有限公司 2025-04-22 CN disclosed
CN-117396462-A Antiviral compounds 英菲克斯治疗有限公司 2024-01-12 CN disclosed