SCHEMBL4334073

SCHEMBL4334073

CC(=O)CC(=O)N(Cl)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.46
KMT2A Q03164 5/20 0.46
NPC1 O15118 4/20 0.46
RAB9A P51151 4/20 0.46
HTT P42858 3/20 0.46
NPSR1 Q6W5P4 2/20 0.46
POLB P06746 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.43
TP53 P04637 2/20 0.43
LMNA P02545 2/20 0.43
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
GLA P06280 2/20 0.41
TSHR P16473 1/20 0.41
PAX8 Q06710 3/20 0.40
MAPT P10636 1/20 0.40
MEN1 O00255 3/20 0.39
JAK2 O60674 1/20 0.38
MITF O75030 1/20 0.38
TDP1 Q9NUW8 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
SCHEMBL9411919 0.80 MTNR1A (0.46) ALDH1A1KMT2ANPC1RAB9AHTT
SCHEMBL4619345 0.80 ALDH1A1 (0.59) ALDH1A1KMT2ANPC1RAB9AHTT
SCHEMBL3156128 0.80 ALDH1A1 (0.48) ALDH1A1KMT2ANPC1RAB9AHTT
SCHEMBL7593591 0.80 ALDH1A1 (0.48) ALDH1A1KMT2ANPC1RAB9AHTT
SCHEMBL3279075 0.78 MTNR1A (0.44) ALDH1A1KMT2ANPC1RAB9AHTT
SCHEMBL6659655 0.78 KMT2A (0.53) ALDH1A1KMT2AHTTNPSR1POLB
SCHEMBL9032197 0.78 ALDH1A1 (0.47) ALDH1A1KMT2ANPC1RAB9AHTT
SCHEMBL5143600 0.78 KMT2A (0.50) ALDH1A1KMT2ANPC1RAB9AHTT
SCHEMBL5143601 0.78 ALDH1A1 (0.50) ALDH1A1KMT2ANPC1RAB9AHTT
SCHEMBL2724523 0.77 NPSR1 (0.46) ALDH1A1KMT2ANPC1RAB9AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1784401-A Novel fused triazolones and uses thereof ASTRAZENECA AB (SE) 2006-06-07 CN claimed
CN-113105751-B Method for processing low aniline pigment diazo component 浙江科隆颜料科技有限公司 2023-02-28 CN disclosed
CN-113105751-A Method for processing low-aniline pigment diazo component 浙江科隆颜料科技有限公司 2021-07-13 CN disclosed
CN-100482663-C Novel fused triazolones and the uses thereof ASTRAZENECA AB SE (SE) 2009-04-29 CN disclosed
US-20090018230-A1 Yellow radiation curing inks CIBA CORP. 2009-01-15 US disclosed
CN-1784401-A Novel fused triazolones and uses thereof ASTRAZENECA AB (SE) 2006-06-07 CN disclosed
US-4115450-A COLOR FORMERS CIBA-GEIGY CORPORATION (US) 1978-09-19 US disclosed
US-4054718-A Heat-sensitive recording material containing a malachite green color former CIBA-GEIGY CORPORATION (US) 1977-10-18 US disclosed