SCHEMBL14700290

SCHEMBL14700290

CN(CCN(C)Cc1cccc(C(=O)C(C)(C)O)c1)Cc1cccc(C(=O)C(C)(C)O)c1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ SIGMAR1 Q99720 5/20 0.41
▸ TMEM97 Q5BJF2 4/20 0.41
▸ ACHE P22303 3/20 0.40
▸ BCHE P06276 1/20 0.40
▸ RIPK1 Q13546 3/20 0.39
▸ HSD17B1 P14061 1/20 0.39
▸ HSD17B2 P37059 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 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
SCHEMBL19370663 0.87 SIGMAR1 (0.41) SMN1; SMN2MEN1KMT2ASIGMAR1TMEM97
SCHEMBL14700304 0.86 MEP1B (0.44) MEN1KMT2ABCHE
SCHEMBL14700308 0.86 PTPN1 (0.49) MEN1KMT2AACHEBCHERIPK1
SCHEMBL14700268 0.82 RORC (0.45) BCHE
SCHEMBL14700278 0.82 MEN1 (0.48) SMN1; SMN2MEN1KMT2AACHEKDM4E
SCHEMBL14700261 0.82 ALDH1A1 (0.47) SMN1; SMN2MEN1KMT2AACHEKDM4E
SCHEMBL14700329 0.82 PTPN1 (0.56) MEN1KMT2ABCHE
SCHEMBL14700257 0.82 CRHBP (0.42) MEN1KMT2A
SCHEMBL14700286 0.81 KMT2A (0.47) MEN1KMT2ASIGMAR1TMEM97
SCHEMBL15197912 0.80 CYP2D6 (0.46) ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2557072-B1 PARA- OR MESO-FUNCTIONALIZED AROMATIC KETONE COMPOUNDS, PREPARATION METHODS THEREOF, AND PHOTOPOLYMERIZATION INITIATORS COMPRISING THE SAME SHENZHEN UV-CHEMTECH CO LTD (CN) 2017-09-20 — — EP disclosed
US-8742175-B2 Para—or meso-functionalized aromatic ketone compounds, preparation methods thereof, and photopolymerization initiators comprising the same Shenzhen UV-Chemtech Co., Ltd. (CN) 2014-06-03 — — US disclosed
US-8742175-B2 Para—or meso-functionalized aromatic ketone compounds, preparation methods thereof, and photopolymerization initiators comprising the same Shenzhen UV-Chemtech Co., Ltd. (CN) 2014-06-03 — — US disclosed
US-20130217877-A1 PARA- OR MESO-FUNCTIONALIZED AROMATIC KETONE COMPOUNDS, PREPARATION METHODS THEREOF, AND PHOTOPOLYMERIZATION INITIATORS COMPRISING THE SAME SHENZHEN UV-CHEMTECH CO., LTD (CN) 2013-08-22 — — US disclosed
US-20130217877-A1 PARA- OR MESO-FUNCTIONALIZED AROMATIC KETONE COMPOUNDS, PREPARATION METHODS THEREOF, AND PHOTOPOLYMERIZATION INITIATORS COMPRISING THE SAME SHENZHEN UV-CHEMTECH CO., LTD (CN) 2013-08-22 — — US disclosed
EP-2557072-A1 PARA- OR MESO-FUNCTIONALIZED AROMATIC KETONE COMPOUNDS, PREPARATION METHODS THEREOF, AND PHOTOPOLYMERIZATION INITIATORS COMPRISING THE SAME Shenzhen UV-Chemtech Co., Ltd (CN) 2013-02-13 — — EP disclosed
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