SCHEMBL18671198

SCHEMBL18671198

CCN(CC)c1ccc(C(=O)c2ccccc2C(=O)NCCNC(=O)c2ccccc2C(=O)c2ccc(N(CC)CC)cc2O)c(O)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.72
▸ MEN1 O00255 1/20 0.72
▸ KMT2A Q03164 1/20 0.72
▸ L3MBTL1 Q9Y468 1/20 0.72
▸ KDM4E B2RXH2 3/20 0.56
▸ ALDH1A1 P00352 3/20 0.56
▸ POLB P06746 1/20 0.56
▸ GAA P10253 1/20 0.56
▸ MAPT P10636 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ NFKB2 Q00653 1/20 0.46
▸ RELA Q04206 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ APP P05067 3/20 0.44
▸ NAAA Q02083 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
SCHEMBL10098743 0.94 SMN1; SMN2 (0.67) SMN1; SMN2MEN1KMT2AL3MBTL1KDM4E
SCHEMBL27913467 0.89 MEN1 (0.89) SMN1; SMN2MEN1KMT2AL3MBTL1KDM4E
SCHEMBL14191554 0.89 SMN1; SMN2 (0.61) SMN1; SMN2MEN1KMT2AL3MBTL1KDM4E
SCHEMBL27603234 0.88 SMN1; SMN2 (0.66) SMN1; SMN2MEN1KMT2AL3MBTL1KDM4E
SCHEMBL4230630 0.86 SMN1; SMN2 (0.57) SMN1; SMN2MEN1KMT2AL3MBTL1KDM4E
SCHEMBL14191558 0.85 MEN1 (0.73) SMN1; SMN2MEN1KMT2AL3MBTL1KDM4E
SCHEMBL22938967 0.85 MEN1 (0.81) SMN1; SMN2MEN1KMT2AL3MBTL1KDM4E
SCHEMBL23571724 0.84 MEN1 (0.55) SMN1; SMN2MEN1KMT2AL3MBTL1KDM4E
SCHEMBL4743736 0.84 MEN1 (0.80) SMN1; SMN2MEN1KMT2AL3MBTL1KDM4E
SCHEMBL39206 0.84 KMT2A (1.00) SMN1; SMN2MEN1KMT2AL3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11234914-B2 Monosubstituted urea derivatives as a self-tanning substance MERCK PATENT GMBH (DE) 2022-02-01 — — US disclosed
US-10893675-B2 Powder formulation containing insect repellent MERCK PATENT GMBH (DE) 2021-01-19 — — US disclosed
US-20200038306-A1 BARBITURIC ACID DERIVATIVES AS SELF-TANNING SUBSTANCES MERCK PATENT GMBH (DE) 2020-02-06 — — US disclosed
US-20200038304-A1 MONOSUBSTITUTED UREA DERIVATIVES AS A SELF-TANNING SUBSTANCE MERCK PATENT GMBH (DE) 2020-02-06 — — US disclosed
US-20190015307-A1 INORGANIC PIGMENTS COMPOSED OF SPECIAL SPHERICAL COMPOSITE PARTICLES AS BOOSTER FOR SUN PROTECTION MERCK PATENT GMBH (DE) 2019-01-17 — — US disclosed
US-RE46698-E1 Use of cyclohexanol derivatives as antimicrobial active compounds MERCK PATENT GMBH (DE) 2018-02-06 — — US disclosed
US-20180020661-A1 POWDER FORMULATION CONTAINING INSECT REPELLENT MERCK PATENT GMBH (DE) 2018-01-25 — — US disclosed
US-20170304168-A1 PHENYL KETONE DERIVATIVES AS SELF-TANNING AGENTS MERCK PATENT GMBH (DE) 2017-10-26 — — US disclosed
US-20170231889-A1 Sunscreen Compositions Comprising Colour Pigments BASF SE (DE) 2017-08-17 — — US disclosed
US-9603784-B2 Process for treating sol-gel capsules MERCK PATENT GMBH (DE) 2017-03-28 — — 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 (8 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-20180020661-A1 POWDER FORMULATION CONTAINING INSECT REPELLENT WAPL, ACHE, BPHL SMN1; SMN2 3119/4885MEN1 50/4885KMT2A 699/4885
US-11234914-B2 Monosubstituted urea derivatives as a self-tanning substance SLC14A1, TYR, UROD SMN1; SMN2 4476/4885MEN1 1983/4885KMT2A 3385/4885
US-20200038304-A1 MONOSUBSTITUTED UREA DERIVATIVES AS A SELF-TANNING SUBSTANCE SLC14A1, TYR, UROD SMN1; SMN2 4476/4885MEN1 1983/4885KMT2A 3385/4885
US-20200038306-A1 BARBITURIC ACID DERIVATIVES AS SELF-TANNING SUBSTANCES TYR, SLC6A1, GABBR1 SMN1; SMN2 4413/4885MEN1 2329/4885KMT2A 3301/4885
US-20170231889-A1 Sunscreen Compositions Comprising Colour Pigments TYR, ERCC1, ERCC4 SMN1; SMN2 3045/4885MEN1 1447/4885KMT2A 2807/4885
US-10893675-B2 Powder formulation containing insect repellent WAPL, ACHE, BPHL SMN1; SMN2 3119/4885MEN1 50/4885KMT2A 699/4885
US-20170304168-A1 PHENYL KETONE DERIVATIVES AS SELF-TANNING AGENTS TYR, PAH, MITF SMN1; SMN2 4778/4885MEN1 3472/4885KMT2A 1639/4885
US-20190015307-A1 INORGANIC PIGMENTS COMPOSED OF SPECIAL SPHERICAL COMPOSITE PARTICLES AS BOOSTER FOR SUN PROTECTION RB1, TYR, XPO5 SMN1; SMN2 2724/4885MEN1 714/4885KMT2A 3479/4885

“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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