SCHEMBL31682595

SCHEMBL31682595

O=C1CSN=C1CCCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DAO P14920 2/20 0.44
▸ HTR2A P28223 1/20 0.40
▸ HDAC1 Q13547 2/20 0.39
▸ HDAC8 Q9BY41 2/20 0.39
▸ HDAC3 O15379 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ ADRA1A P35348 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ SLC6A3 Q01959 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HDAC7 Q8WUI4 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ HDAC10 Q969S8 1/20 0.39
▸ HDAC11 Q96DB2 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ HDAC9 Q9UKV0 1/20 0.39
▸ HDAC5 Q9UQL6 1/20 0.39
▸ GSK3A P49840 2/20 0.39
▸ GSK3B P49841 2/20 0.39
▸ SIGMAR1 Q99720 2/20 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
SCHEMBL54347 0.69 HTR2A (0.70) HTR2AHDAC1HDAC8HDAC3MAPK1
Ammonia Solution, Strong SCHEMBL8817973 0.67 HTR2A (0.67) HTR2AHDAC1HDAC8HDAC3MAPK1
SCHEMBL29268834 0.67 HTR2A (0.67) HTR2AHDAC1HDAC8HDAC3MAPK1
SCHEMBL10354668 0.67 HTR2A (0.67) HTR2AHDAC1HDAC8HDAC3MAPK1
SCHEMBL9069707 0.67 HTR2A (0.75) HTR2AHDAC1HDAC8HDAC3MAPK1
SCHEMBL10831414 0.67 HTR2A (0.67) HTR2AHDAC1HDAC8HDAC3MAPK1
SCHEMBL7198239 0.67 MAPT (0.42) GSK3AGSK3BSIGMAR1FAAHMGLL
SCHEMBL28353517 0.65 HTR2A (0.64) HTR2AHDAC1HDAC8HDAC3MAPK1
SCHEMBL15347959 0.65 HTR2A (0.71) HTR2AHDAC1HDAC8HDAC3MAPK1
SCHEMBL451456 0.65 MAOA (0.74) HTR2ASIGMAR1MAOAMAPTRXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12473444-B2 Marker inks and methods for preparing thereof Shenzhen Thousandshores Technology Co., Ltd. (CN) 2025-11-18 — — US disclosed
US-20250282965-A1 MARKER INKS AND METHODS FOR PREPARING THEREOF Shenzhen Thousandshores Technology Co., Ltd. (CN) 2025-09-11 — — US disclosed
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