SCHEMBL30718232

SCHEMBL30718232

OB(O)Oc1ccc2c(c1)OCCO2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.51
TSHR P16473 2/20 0.49
MAOA P21397 6/20 0.49
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
HTT P42858 1/20 0.44
BLM P54132 1/20 0.44
ALOX5 P09917 1/20 0.42
ADRA2A P08913 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
PKM P14618 1/20 0.40
NFKB1 P19838 1/20 0.40
RAB9A P51151 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TRPV1 Q8NER1 1/20 0.40

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
SCHEMBL2931212 1.00 MAOB (0.51) MAOBTSHRMAOALMNAMAPT
SCHEMBL7931200 0.93 MAOB (0.45) MAOBTSHRMAOALMNAMAPT
SCHEMBL31366954 0.89 MAOB (0.51) MAOBMAOALMNANPC1TP53
SCHEMBL791137 0.89 MAOB (0.51) MAOBMAOALMNANPC1TP53
SCHEMBL20291465 0.86 TSHR (0.44) MAOBTSHRMAOALMNAMAPT
SCHEMBL7481006 0.84 MAOB (0.51) MAOBTSHRMAOALMNAMAPT
SCHEMBL38661426 0.81 TSHR (0.46) MAOBTSHRMAOALMNAMAPT
SCHEMBL31180358 0.80 PRKCI (0.47) MAPTNPC1PKMRAB9ASMN1; SMN2
SCHEMBL2937683 0.80 PRKCI (0.47) MAPTNPC1PKMRAB9ASMN1; SMN2
SCHEMBL7928453 0.78 CTNNB1 (0.43) TSHR

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-119330967-B MET transcription inhibitor and preparation method and application thereof 中国药科大学 2025-04-25 CN disclosed
CN-119330967-A MET transcription inhibitor and preparation method and application thereof 中国药科大学 2025-01-21 CN disclosed
CN-117157284-A CTLA-4 small molecule degradation agent and application thereof 苏州国匡医药科技有限公司 2023-12-01 CN disclosed