SCHEMBL31616418

SCHEMBL31616418

COc1ccc(NC(=S)NC(C)c2cccc3ccccc23)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LTC4S Q16873 2/20 0.57
▸ CYP1A2 P05177 1/20 0.55
▸ CYP2C19 P33261 1/20 0.55
▸ KMT2A Q03164 5/20 0.51
▸ ALDH1A1 P00352 4/20 0.51
▸ MAPT P10636 3/20 0.51
▸ HTT P42858 2/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ EGFR P00533 1/20 0.50
▸ KDR P35968 1/20 0.50
▸ MAOB P27338 1/20 0.50
▸ RAB9A P51151 2/20 0.49
▸ HPGD P15428 2/20 0.49
▸ ALOX12 P18054 1/20 0.49
▸ LMNA P02545 1/20 0.48
▸ GAA P10253 2/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL31616447 1.00 LTC4S (0.57) LTC4SCYP1A2CYP2C19KMT2AALDH1A1
SCHEMBL31616340 0.88 KMT2A (0.66) LTC4SKMT2AALDH1A1MAPTHTT
SCHEMBL31616429 0.88 KMT2A (0.66) LTC4SKMT2AALDH1A1MAPTHTT
SCHEMBL31616465 0.86 KMT2A (0.53) KMT2AALDH1A1MEN1RAB9ALMNA
SCHEMBL31616452 0.86 KMT2A (0.53) KMT2AALDH1A1MEN1RAB9ALMNA
SCHEMBL31616458 0.86 KMT2A (0.53) KMT2AALDH1A1MEN1RAB9ALMNA
SCHEMBL31616470 0.84 LTC4S (0.60) LTC4SKMT2AMAPTHTTMEN1
SCHEMBL31616416 0.84 LTC4S (0.60) LTC4SKMT2AMAPTHTTMEN1
SCHEMBL31616432 0.84 LTC4S (0.60) LTC4SKMT2AMAPTHTTMEN1
SCHEMBL31616368 0.84 LTC4S (0.60) LTC4SKMT2AMEN1LMNAGAA

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
WO-2025122121-A2 COMPOUNDS FOR THE TREATMENT OF ALZHEIMER'S DISEASE AND THE METHOD OF OBTAINING THESE COMPOUNDS HACETTEPE UNIVERSITESI REKTORLUK (TR) 2025-06-12 — — WO claimed
WO-2025122121-A2 COMPOUNDS FOR THE TREATMENT OF ALZHEIMER'S DISEASE AND THE METHOD OF OBTAINING THESE COMPOUNDS HACETTEPE UNIVERSITESI REKTORLUK (TR) 2025-06-12 — — WO disclosed
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