SCHEMBL5660237

SCHEMBL5660237

CC(C)(C)C(c1ccc(OCc2ccccn2)cc1)c1ccc(-c2nnn(CC3CCN(C(=O)O)C(C(C)(C)C)C3)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ ADAMTS4 O75173 1/20 0.36
▸ LMNA P02545 3/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ ALOX5AP P20292 2/20 0.35
▸ MAOB P27338 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ TYK2 P29597 1/20 0.35
▸ JAK3 P52333 1/20 0.35
▸ LTA4H P09960 2/20 0.34
▸ PARP10 Q53GL7 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ CTDSP1 Q9GZU7 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ ALDH1A1 P00352 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
SCHEMBL3922996 0.89 LTA4H (0.38) ALOX5MEN1KMT2AADAMTS4LMNA
SCHEMBL5660242 0.83 YAP1 (0.42) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL2246968 0.81 NPC1 (0.41) ALOX5LMNASMN1; SMN2NPC1RAB9A
SCHEMBL3922997 0.81 MEN1 (0.42) MEN1KMT2ALMNASMN1; SMN2NPC1
SCHEMBL13248365 0.80 MEN1 (0.56) MEN1KMT2AADAMTS4LMNASMN1; SMN2
SCHEMBL2245019 0.77 NPC1 (0.47) KMT2ALMNASMN1; SMN2NPC1RAB9A
SCHEMBL2248325 0.77 NPC1 (0.39) ALOX5LMNASMN1; SMN2NPC1RAB9A
SCHEMBL2246935 0.77 NPC1 (0.39) ALOX5LMNASMN1; SMN2NPC1RAB9A
SCHEMBL2996834 0.76 ADAMTS4 (0.46) ALOX5MEN1KMT2AADAMTS4LMNA
SCHEMBL13248366 0.76 NPSR1 (0.45) MEN1KMT2ALMNASMN1; SMN2NPC1

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-8729104-B2 Diphenyl substituted alkanes as flap inhibitors MERCK SHARP & DOHME CORP. (US) 2014-05-20 — — US disclosed
US-20070287736-A1 Diphenyl Substituted Alkanes as Flap Inhibitors MERCK SHARP & DOHME CORP. 2007-12-13 — — 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-20070287736-A1 Diphenyl Substituted Alkanes as Flap Inhibitors ALOX5, ALOX15, ALOX15B ALOX5 1/4885MEN1 4687/4885KMT2A 4210/4885

“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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