SCHEMBL30856147

SCHEMBL30856147

O=CC1=C(Br)c2cc(Br)ccc2CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
PARP10 Q53GL7 2/20 0.45
PARP1 P09874 1/20 0.45
TYMS P04818 2/20 0.38
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
SRD5A1 P18405 1/20 0.37
SRD5A2 P31213 1/20 0.37
S100A4 P26447 1/20 0.35
ERN1 O75460 1/20 0.35
METAP1 P53582 1/20 0.35
PBRM1 Q86U86 1/20 0.34
TDP2 O95551 1/20 0.34
PARP11 Q9NR21 1/20 0.34
CYP19A1 P11511 2/20 0.33
CYP11B1 P15538 2/20 0.33
CYP11B2 P19099 2/20 0.33
PNMT P11086 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL30856007 0.83 F7 (0.42) TDP1L3MBTL1PARP10PARP1TYMS
SCHEMBL29951071 0.83 PARP10 (0.46) TDP1L3MBTL1PARP10PARP1TYMS
SCHEMBL31620343 0.83 PARP1 (0.42) TDP1L3MBTL1PARP10PARP1TYMS
SCHEMBL3267426 0.83 F7 (0.42) TDP1L3MBTL1PARP10PARP1TYMS
SCHEMBL3267757 0.83 PARP1 (0.42) TDP1L3MBTL1PARP10PARP1TYMS
SCHEMBL29615759 0.78 CES1 (0.47) TDP1L3MBTL1PARP10PARP1MAOA
SCHEMBL4268656 0.78 CES1 (0.47) TDP1L3MBTL1PARP10PARP1MAOA
SCHEMBL598138 0.76 TDP1 (0.61) TDP1L3MBTL1PARP10PARP1TYMS
SCHEMBL3666301 0.73 PARP10 (0.44) TDP1L3MBTL1PARP10PARP1TYMS
SCHEMBL358939 0.72 TDP1 (0.81) TDP1L3MBTL1PARP10PARP1TYMS

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
CN-120152713-A Tricyclic aryl derivatives and compositions and methods thereof 昂胜医疗科技公司 2025-06-13 CN disclosed
EP-4561562-A2 TRICYCLIC ARYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF Ensem Therapeutics, Inc. (US) 2025-06-04 EP disclosed
WO-2024026128-A2 TRICYCLIC ARYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF ENSEM THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed