SCHEMBL28867399

SCHEMBL28867399

COCSc1ccccc1CCl

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.33
▸ TSHR P16473 1/20 0.33
▸ APOBEC3G Q9HC16 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ KMT2A Q03164 4/20 0.32
▸ POLB P06746 3/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ HSD17B10 Q99714 2/20 0.31
▸ HPGD P15428 1/20 0.31
▸ SLC6A4 P31645 1/20 0.31
▸ ACHE P22303 1/20 0.30
▸ GFER P55789 1/20 0.30

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
SCHEMBL4390654 0.78 CYP3A4 (0.32) KMT2APOLBHSD17B10HPGDACHE
SCHEMBL9988198 0.77 APOBEC3G (0.37) ALDH1A1TSHRAPOBEC3GKMT2APOLB
SCHEMBL8881481 0.75 MCHR1 (0.43) ALDH1A1TSHRKMT2AMEN1HPGD
SCHEMBL8868904 0.75 MEN1 (0.52) ALDH1A1APOBEC3GKMT2APOLBMEN1
SCHEMBL1146257 0.74 CHRM2 (0.48) ALDH1A1TSHRAPOBEC3GKMT2AMEN1
SCHEMBL23734864 0.73 MTNR1A (0.50) ALDH1A1TSHRTP53KMT2APOLB
SCHEMBL7086960 0.73 APOBEC3G (0.58) ALDH1A1TSHRAPOBEC3GKMT2APOLB
SCHEMBL5250559 0.73 SLC6A4 (0.42) ALDH1A1TSHRAPOBEC3GKMT2ASLC6A4
SCHEMBL11857807 0.73 PKM (0.38) ALDH1A1TP53KMT2APOLBHSD17B10
SCHEMBL27632178 0.72 KMT2A (0.59) ALDH1A1KMT2APOLBMEN1

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
CN-115087440-A TRPML modulators 卡斯玛治疗公司 2022-09-20 — — CN disclosed
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