SCHEMBL25398607

SCHEMBL25398607

COc1ccc(Cc2c(Cl)cc(O)cc2Cl)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 4/20 0.43
▸ HTR2A P28223 3/20 0.43
▸ KCNH2 Q12809 2/20 0.43
▸ POLB P06746 2/20 0.42
▸ ESR1 P03372 1/20 0.41
▸ CYP19A1 P11511 1/20 0.41
▸ ESR2 Q92731 1/20 0.41
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A3 Q01959 1/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ CASP3 P42574 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ SENP8 Q96LD8 1/20 0.40
▸ SENP7 Q9BQF6 1/20 0.40
▸ SENP6 Q9GZR1 1/20 0.40
▸ CALM1 P0DP23 1/20 0.38
▸ HSP90AA1 P07900 1/20 0.38

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
SCHEMBL3783737 0.80 HTT (0.50) SLC6A4HTR2AKCNH2RAB9AMAPK1
SCHEMBL25396490 0.78 SLC6A4 (0.39) SLC6A4HTR2AKCNH2SLC6A2SLC6A3
SCHEMBL3840431 0.76 LTA4H (0.50) SLC6A4HTR2AKCNH2SMN1; SMN2LMNA
SCHEMBL3773755 0.76 MEN1 (0.42) SLC6A4HTR2AKCNH2NPC1RAB9A
SCHEMBL25398816 0.76 GAA (0.45) POLBSMN1; SMN2KDM4ELMNAPTGS2
SCHEMBL5753110 0.75 ALDH1A1 (0.54) SLC6A4HTR2AKCNH2POLBESR1
SCHEMBL19534980 0.75 SLC6A4 (0.46) SLC6A4HTR2AKCNH2POLBESR1
SCHEMBL473944 0.73 HSD17B10 (0.46) SLC6A4HTR2AKCNH2POLBKDM4E
SCHEMBL28301168 0.73 LTA4H (0.56) SLC6A4HTR2AKCNH2SLC6A2SLC6A3
SCHEMBL8340513 0.73 SLC6A4 (0.47) SLC6A4HTR2AKCNH2POLBSLC6A2

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-2023177667-A1 THYROID HORMONE RECEPTOR AGONISTS BRII BIOSCIENCES, INC. (US) 2023-09-21 — — WO disclosed
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