SCHEMBL30109166

SCHEMBL30109166

Cc1cccc2ccn(C)c12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 1/20 0.41
HCRTR1 O43613 1/20 0.41
RAB9A P51151 1/20 0.41
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40
ALKBH5 Q6P6C2 1/20 0.39
FTO Q9C0B1 1/20 0.39
CYP2A6 P11509 3/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 3/20 0.39
P2RX7 Q99572 1/20 0.38
NR3C1 P04150 1/20 0.36
PGR P06401 1/20 0.36
CCR5 P51681 1/20 0.36
CMA1 P23946 1/20 0.35
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34

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
SCHEMBL436336 1.00 MEN1 (0.41) MEN1KMT2ANPC1HCRTR1RAB9A
SCHEMBL13836115 0.77 PSMD14 (0.37) NR3C1PGRCMA1PTPN11
SCHEMBL30847966 0.76 PRKCI (0.39) ALDH1A1CMA1PTPN11
SCHEMBL2625811 0.76 CDK4 (0.41) CMA1SLC6A2SLC6A4
SCHEMBL2052186 0.76 CYP1A2 (0.38) MEN1KMT2AALDH1A1CYP1A2CMA1
SCHEMBL24701710 0.76 ADRA2A (0.39) MEN1KMT2ANPC1HCRTR1RAB9A
SCHEMBL29989147 0.76 CDK4 (0.41) CMA1SLC6A2SLC6A4
SCHEMBL2178459 0.76 CDK4 (0.43) ALDH1A1NR3C1PGRCMA1SLC6A2
SCHEMBL4387353 0.76 PRKCI (0.39) ALDH1A1CMA1PTPN11
SCHEMBL8017339 0.76 CMA1 (0.35) NR3C1PGRCCR5CMA1PTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119409615-A 2- (Indol-3-yl) phenol compound and synthesis method thereof 湘潭大学 2025-02-11 CN claimed
CN-117903161-A Tetrathiodiindole compound and derivative, synthetic method and application thereof 衡阳师范学院 2024-04-19 CN claimed
CN-116813639-A Synthesis method of polysubstituted [1,2,3,4,5] pentathio [6,7-b ] indole and derivative 衡阳师范学院 2023-09-29 CN claimed
CN-119409615-A 2- (Indol-3-yl) phenol compound and synthesis method thereof 湘潭大学 2025-02-11 CN disclosed
CN-115974845-B Preparation method of Ornitinib intermediate 奥锐特药业股份有限公司 2024-09-20 CN disclosed
CN-117903161-A Tetrathiodiindole compound and derivative, synthetic method and application thereof 衡阳师范学院 2024-04-19 CN disclosed
CN-117510392-A Preparation method of bisindolyl compound 吉林大学 2024-02-06 CN disclosed
CN-117164498-A Method for synthesizing cyclic monoterpene indole compound 苏州大学 2023-12-05 CN disclosed
CN-116813639-A Synthesis method of polysubstituted [1,2,3,4,5] pentathio [6,7-b ] indole and derivative 衡阳师范学院 2023-09-29 CN disclosed
CN-115974845-A Preparation method of oxitinib intermediate 奥锐特药业股份有限公司 2023-04-18 CN disclosed
WO-2023278698-A1 COMPLEMENT INHIBITION APELLIS PHARMACEUTICALS, INC. (US) 2023-01-05 WO disclosed