SCHEMBL21183154

SCHEMBL21183154

CC1(C)c2cc(C(=O)C(C)(C)N3CCOCC3)ccc2-c2ccc(-n3nnc4ccccc43)cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ NPC1 O15118 3/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ APAF1 O14727 2/20 0.40
▸ TDP2 O95551 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ BLM P54132 1/20 0.40
▸ SMAD3 P84022 1/20 0.40
▸ HKDC1 Q2TB90 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ TSHR P16473 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ TNKS O95271 1/20 0.37
▸ PDK2 Q15119 1/20 0.34

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
SCHEMBL23805871 0.81 ALDH1A1 (0.56) SMN1; SMN2NPC1ALDH1A1MAPTHPGD
SCHEMBL21024699 0.81 ALDH1A1 (0.48) SMN1; SMN2NPC1ALDH1A1MAPTKDM4E
SCHEMBL21025029 0.80 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1HPGDTSHRMAPK1
SCHEMBL23805901 0.76 ALDH1A1 (0.50) SMN1; SMN2NPC1ALDH1A1HPGDKDM4E
SCHEMBL23805894 0.76 PDK2 (0.44) SMN1; SMN2NPC1ALDH1A1MAPTLMNA
SCHEMBL21024770 0.74 ALDH1A1 (0.66) SMN1; SMN2NPC1ALDH1A1MAPTHPGD
SCHEMBL15632452 0.72 TNKS (0.42) SMN1; SMN2NPC1ALDH1A1MAPTHPGD
SCHEMBL21024691 0.71 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1KDM4ELMNATHRB
SCHEMBL23805887 0.70 PDK2 (0.48) PDK2
SCHEMBL22745167 0.68 TSHR (0.48) SMN1; SMN2NPC1ALDH1A1HPGDTSHR

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
EP-3514135-A1 FLUORENE PHOTOINITIATOR, PREPARATION METHOD THEREFOR, PHOTOCURABLE COMPOSITION HAVING SAME, AND USE OF SAME IN PHOTOCURING FIELD Changzhou Tronly Advanced Electronic Materials Co., Ltd. (CN) 2019-07-24 — — EP disclosed
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