SCHEMBL17386366

SCHEMBL17386366

COC(=O)c1ccc(OCCc2cc(OC)cc(C)c2Br)c(B2OC(C)(C)C(C)(C)O2)c1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ UCHL1 P09936 1/20 0.36
▸ CXCR2 P25025 4/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ KMT2A Q03164 1/20 0.34
▸ ALDH1A1 P00352 5/20 0.33
▸ CYP2C9 P11712 3/20 0.33
▸ TSHR P16473 2/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ LIPE Q05469 1/20 0.32
▸ MAPK14 Q16539 1/20 0.32
▸ MAPT P10636 1/20 0.32

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
SCHEMBL17429673 0.91 TDP1 (0.34) UCHL1CXCR2TDP1L3MBTL1ALDH1A1
SCHEMBL17385776 0.86 UCHL1 (0.38) UCHL1CXCR2KMT2AALDH1A1CYP2C9
SCHEMBL17386122 0.82 UCHL1 (0.39) UCHL1CXCR2TDP1L3MBTL1KMT2A
SCHEMBL17385847 0.81 UCHL1 (0.34) UCHL1CXCR2TSHRNPSR1LMNA
SCHEMBL17429672 0.79 UCHL1 (0.36) UCHL1CXCR2TDP1L3MBTL1KMT2A
SCHEMBL23803972 0.78 NLRP3 (0.40) UCHL1MAPT
SCHEMBL17386215 0.78 MAPK14 (0.33) UCHL1CXCR2TSHRNPSR1LMNA
SCHEMBL28602571 0.77 UCHL1 (0.36) UCHL1CXCR2KMT2ATSHRLMNA
SCHEMBL31092565 0.77 MAPT (0.39) UCHL1CXCR2TDP1L3MBTL1KMT2A
SCHEMBL17386167 0.77 EGFR (0.43) UCHL1KMT2AALDH1A1CYP2C9LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9643946-B2 Tricyclic compound and use thereof SK CHEMICALS CO., LTD. (KR) 2017-05-09 — — US disclosed
US-9643946-B2 Tricyclic compound and use thereof SK CHEMICALS CO., LTD. (KR) 2017-05-09 — — US disclosed
US-20160009677-A1 TRICYCLIC COMPOUND AND USE THEREOF SK CHEMICALS CO., LTD. (KR) 2016-01-14 — — US disclosed
US-20160009677-A1 TRICYCLIC COMPOUND AND USE THEREOF SK CHEMICALS CO., LTD. (KR) 2016-01-14 — — US disclosed
EP-2963027-A1 TRICYCLIC COMPOUND AND USE THEREOF SK Chemicals Co., Ltd. (KR) 2016-01-06 — — EP 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-20160009677-A1 TRICYCLIC COMPOUND AND USE THEREOF GPR65, GPR119, GPR35 UCHL1 4494/4885CXCR2 461/4885TDP1 4431/4885

“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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