SCHEMBL18178035

SCHEMBL18178035

COC(=O)Oc1ccccc1COc1ccc(C)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.52
▸ MAOB P27338 4/20 0.47
▸ MEN1 O00255 4/20 0.47
▸ KMT2A Q03164 4/20 0.47
▸ FFAR1 O14842 3/20 0.46
▸ FFAR4 Q5NUL3 2/20 0.46
▸ HPGD P15428 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ MAPT P10636 2/20 0.44
▸ HTT P42858 1/20 0.44
▸ PARP14 Q460N5 1/20 0.44
▸ PARP10 Q53GL7 1/20 0.44
▸ PTPRC P08575 1/20 0.43
▸ PTPN1 P18031 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ MAOA P21397 1/20 0.43

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
SCHEMBL18182150 0.86 RAB9A (0.49) NPC1MEN1KMT2AFFAR1FFAR4
SCHEMBL18178426 0.86 MAOB (0.47) NPC1MAOBMEN1KMT2AFFAR1
SCHEMBL18178335 0.85 MAPT (0.48) NPC1MAOBMEN1KMT2AHPGD
SCHEMBL18178108 0.84 NPC1 (0.45) NPC1MAOBMEN1KMT2AFFAR1
SCHEMBL18178056 0.83 NPC1 (0.44) NPC1MAOBMEN1KMT2AFFAR1
SCHEMBL18182839 0.83 PARP10 (0.46) MAOBMEN1KMT2AFFAR1FFAR4
SCHEMBL18138655 0.82 FFAR4 (0.49) NPC1FFAR1FFAR4HPGDALDH1A1
SCHEMBL18178238 0.82 HDAC8 (0.47) NPC1MAOBMEN1KMT2AALDH1A1
SCHEMBL18178099 0.82 PARP10 (0.56) MAOBMEN1KMT2AFFAR1PARP14
SCHEMBL18178037 0.82 NPC1 (0.44) NPC1MAOBMEN1KMT2AFFAR1

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-9573904-B2 Aromatic compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-21 — — US disclosed
US-20160311775-A1 AROMATIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-10-27 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160311775-A1 AROMATIC COMPOUND AND USE THEREOF ZCCHC8, CBR3, CBX8 NPC1 1520/4885MAOB 1775/4885MEN1 3638/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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