SCHEMBL17429646

SCHEMBL17429646

COC(=O)c1ccc(CCCc2cccc(C)c2)c(B2OC(C)(C)C(C)(C)O2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP4A11 Q02928 4/20 0.45
▸ CYP4F2 P78329 3/20 0.45
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ ALOX12 P18054 1/20 0.44
▸ LIPG Q9Y5X9 2/20 0.39
▸ LPL P06858 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ THRB P10828 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ LOXL2 Q9Y4K0 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ POLB P06746 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37

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
SCHEMBL17429651 0.91 CYP4A11 (0.38) CYP4A11CYP4F2MEN1KMT2AMAPT
SCHEMBL17386132 0.89 MTNR1A (0.45) CYP4A11CYP4F2MEN1KMT2ALMNA
SCHEMBL17418052 0.86 UCHL1 (0.40) CYP4A11CYP4F2KMT2AMAPTALDH1A1
SCHEMBL17429645 0.84 TDP1 (0.35) MAPTSMN1; SMN2ALDH1A1LMNAKDM4E
SCHEMBL17429702 0.82 CXCR2 (0.35) CYP4A11CYP4F2MEN1KMT2AALDH1A1
SCHEMBL17429652 0.81 UCHL1 (0.33) CYP4A11MAPTALDH1A1KDM4ETP53
SCHEMBL28600815 0.80 PTGER4 (0.44) —
SCHEMBL17400118 0.79 LIPG (0.37) CYP4A11CYP4F2LIPGALDH1A1KDM4E
SCHEMBL18362455 0.79 CXCR2 (0.39) CYP4A11CYP4F2KMT2AMAPTALOX12
SCHEMBL23795687 0.79 UCHL1 (0.41) MEN1KMT2AMAPTALOX12SMN1; SMN2

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-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

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 CYP4A11 159/4885CYP4F2 958/4885MEN1 2105/4885

“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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