SCHEMBL2937877

SCHEMBL2937877

O=C(O)NCc1ccc2c(c1)OCO2

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.70
RAB9A P51151 2/20 0.69
NPC1 O15118 2/20 0.69
HPGD P15428 2/20 0.69
ALDH1A1 P00352 4/20 0.69
GAA P10253 1/20 0.69
TDP1 Q9NUW8 1/20 0.68
MEN1 O00255 1/20 0.67
LMNA P02545 1/20 0.67
MAPK1 P28482 1/20 0.67
MMP13 P45452 1/20 0.67
KMT2A Q03164 1/20 0.67
ALDH2 P05091 1/20 0.66
HTT P42858 1/20 0.66
HSD17B10 Q99714 2/20 0.65
TP53 P04637 1/20 0.65
CRHBP P24387 1/20 0.65
RECQL P46063 1/20 0.65
CRHR2 Q13324 1/20 0.65
HSP90AA1 P07900 1/20 0.63

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
SCHEMBL2937839 0.90 ALDH1A1 (0.65) SMN1; SMN2RAB9ANPC1HPGDALDH1A1
SCHEMBL179085 0.88 RAB9A (0.76) SMN1; SMN2RAB9ANPC1HPGDALDH1A1
SCHEMBL179082 0.85 HPGD (0.73) SMN1; SMN2RAB9ANPC1HPGDALDH1A1
SCHEMBL7322125 0.85 SMN1; SMN2 (0.68) SMN1; SMN2RAB9ANPC1HPGDALDH1A1
SCHEMBL4991673 0.85 SMN1; SMN2 (0.73) SMN1; SMN2RAB9ANPC1HPGDALDH1A1
SCHEMBL5815420 0.85 SMN1; SMN2 (0.68) SMN1; SMN2RAB9ANPC1HPGDALDH1A1
SCHEMBL19030884 0.84 SMN1; SMN2 (0.58) SMN1; SMN2RAB9ANPC1HPGDALDH1A1
SCHEMBL179025 0.84 HPGD (0.84) SMN1; SMN2RAB9ANPC1HPGDALDH1A1
SCHEMBL2730357 0.84 ALDH1A1 (0.62) SMN1; SMN2RAB9ANPC1ALDH1A1TDP1
SCHEMBL179079 0.84 ALDH1A1 (0.70) SMN1; SMN2RAB9ANPC1HPGDALDH1A1

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
EP-0269650-A1 SYNTHESIS OF ANTIULCER COMPOUNDS RECORDATI FARMA SRL (IT) 1988-06-08 EP claimed
WO-1987005902-A1 SYNTHESIS OF ANTIULCER COMPOUNDS RECORDATI FARMA SRL (IT) 1987-10-08 WO claimed
EP-3452477-B1 ADENINE DERIVATIVES AS PROTEIN KINASE INHIBITORS B C I PHARMA (BE) 2023-09-13 EP disclosed
EP-2593079-B1 MENTHYL CARBAMATE COMPOUNDS AS SKIN AND/OR HAIR LIGHTENING ACTIVES SYMRISE AG (DE) 2016-11-16 EP disclosed
US-9060949-B2 Menthyl carbamate compounds as skin and/or hair lightening actives SYMRISE AG (DE) 2015-06-23 US disclosed
US-20130129646-A1 MENTHYL CARBAMATE COMPOUNDS AS SKIN AND/OR HAIR LIGHTENING ACTIVES SYMRISE AG (DE) 2013-05-23 US disclosed
EP-1836163-B1 PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE DEPENDING ON THE ACTIVITY OF RENIN NOVARTIS AG (CH) 2010-09-22 EP disclosed
US-20100087427-A1 PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE DEPENDING ON THE ACTIVITY OF RENIN BREITENSTEIN WERNER 2010-04-08 US disclosed
US-20080249075-A1 C11 Modified Retrosteroids as Progesterone Receptor Modulator Compounds SOLVAY PHARMACEUTICALS GMBH (DE) 2008-10-09 US disclosed
US-6967196-B1 Sulfonamide compounds and uses thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2005-11-22 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 (3 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-20100087427-A1 PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE DEPENDING ON THE ACTIVITY OF RENIN REN, ACE, PEPD SMN1; SMN2 2748/4885RAB9A 287/4885NPC1 4017/4885
US-20130129646-A1 MENTHYL CARBAMATE COMPOUNDS AS SKIN AND/OR HAIR LIGHTENING ACTIVES TYR, CRAT, SUCLG1 SMN1; SMN2 4666/4885RAB9A 3830/4885NPC1 3818/4885
US-20080249075-A1 C11 Modified Retrosteroids as Progesterone Receptor Modulator Compounds HSD17B11, CYP19A1, ESRRA SMN1; SMN2 2292/4885RAB9A 1020/4885NPC1 1422/4885

“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.