SCHEMBL20051405

SCHEMBL20051405

NC(=O)NCc1ccc2c(c1)CCO2

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.66
NPC1 O15118 1/20 0.66
POLB P06746 1/20 0.66
MAPT P10636 1/20 0.56
CHRM4 P08173 1/20 0.54
AURKA O14965 1/20 0.53
RPS6KB1 P23443 1/20 0.53
EGLN1 Q9GZT9 1/20 0.52
KDM1A O60341 1/20 0.49
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
GSK3B P49841 1/20 0.48
RYR2 Q92736 1/20 0.47
ALDH1A1 P00352 1/20 0.47
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47

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
SCHEMBL3620383 0.88 RAB9A (0.70) RAB9ANPC1POLBMAPTCHRM4
SCHEMBL21690928 0.88 CYP2C19 (0.53) RAB9ANPC1POLBMAPTCHRM4
SCHEMBL6028980 0.85 RAB9A (0.59) RAB9ANPC1POLBMAPTCHRM4
SCHEMBL14640722 0.81 RAB9A (0.58) RAB9ANPC1POLBMAPTCHRM4
SCHEMBL18539279 0.81 RAB9A (0.53) RAB9ANPC1POLBMAPTCHRM4
SCHEMBL8358827 0.80 RAB9A (0.61) RAB9ANPC1POLBMAPTCHRM4
SCHEMBL13149469 0.80 RAB9A (0.78) RAB9ANPC1POLBMAPTCHRM4
SCHEMBL17241709 0.80 RAB9A (0.57) RAB9ANPC1POLBMAPTCHRM4
SCHEMBL2777357 0.80 RAB9A (0.52) RAB9ANPC1POLBMAPTCHRM4
SCHEMBL20778596 0.79 ALDH1A1 (0.68) RAB9ANPC1POLBMAPTCHRM4

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 4 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
EP-3522993-B1 MONOSUBSTITUTED UREA DERIVATIVES AS A SELF-TANNING SUBSTANCE MERCK PATENT GMBH (DE) 2021-04-07 EP disclosed
US-20200038304-A1 MONOSUBSTITUTED UREA DERIVATIVES AS A SELF-TANNING SUBSTANCE MERCK PATENT GMBH (DE) 2020-02-06 US disclosed
WO-2018065358-A1 MONOSUBSTITUTED UREA DERIVATIVES AS A SELF-TANNING SUBSTANCE MERCK PATENT GMBH (DE) 2018-04-12 WO 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 (2 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-11234914-B2 Monosubstituted urea derivatives as a self-tanning substance SLC14A1, TYR, UROD RAB9A 1932/4885NPC1 1358/4885POLB 673/4885
US-20200038304-A1 MONOSUBSTITUTED UREA DERIVATIVES AS A SELF-TANNING SUBSTANCE SLC14A1, TYR, UROD RAB9A 1932/4885NPC1 1358/4885POLB 673/4885

“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.