SCHEMBL1156415

SCHEMBL1156415

O=C(Cc1ccccc1C1CC1)Cc1ccccc1C1CC1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 2/20 0.43
ASPH Q12797 1/20 0.42
KDM8 Q8N371 1/20 0.42
PTGDR2 Q9Y5Y4 2/20 0.39
NAAA Q02083 1/20 0.39
HSD17B10 Q99714 1/20 0.37
AKR1B1 P15121 1/20 0.36
AKR1C3 P42330 1/20 0.35
AKR1C1 Q04828 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C19 P33261 1/20 0.35
NOTUM Q6P988 1/20 0.35
ALDH1A1 P00352 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
RBP4 P02753 1/20 0.35

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
SCHEMBL3107649 0.91 PTGDR2 (0.50) SLC6A2SLC6A4SLC6A3ASPHKDM8
SCHEMBL7968570 0.86 AKR1B1 (0.53) SLC6A2SLC6A4SLC6A3ASPHKDM8
SCHEMBL11359967 0.85 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3ASPHKDM8
SCHEMBL17080017 0.80 KDM4E (0.46) SLC6A2SLC6A4SLC6A3ASPHKDM8
SCHEMBL3633503 0.79 PTGDR2 (0.54) SLC6A2SLC6A4SLC6A3ASPHKDM8
SCHEMBL3979460 0.78 PTGDR2 (0.45) SLC6A2SLC6A4SLC6A3ASPHKDM8
SCHEMBL2550680 0.78 PTGDR2 (0.56) PTGDR2NAAAAKR1B1
SCHEMBL5049599 0.78 PTGDR2 (0.42) SLC6A2SLC6A4SLC6A3ASPHKDM8
SCHEMBL21767564 0.78 PKM (0.48) SLC6A2SLC6A4SLC6A3HSD17B10ALDH1A1
SCHEMBL7135459 0.77 HCRTR2 (0.45) SLC6A2SLC6A4SLC6A3ASPHKDM8

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
EP-2242736-B1 PROCESS FOR THE PREPARATION OF PHARMACEUTICAL INTERMEDIATES EGIS GYOGYSZERGYAR NYILVANOSAN MUEKOEDOE RESZVENYTARSASAG (HU) 2011-09-14 EP disclosed
US-20110040093-A1 PROCESS FOR THE PREPARATION OF PHARMACEUTICAL INTERMEDIATE EGIS GYOGYSZERGYAR NYILVANOSAN MUKODO RESZVENYTARSASAG (HU) 2011-02-17 US disclosed
EP-2242736-A1 PROCESS FOR THE PREPARATION OF PHARMACEUTICAL I NTERM EDIATES Egis Gyógyszergyár Nyilvánosan Müködö Részvénytársaság (HU) 2010-10-27 EP disclosed
WO-2009068924-A1 PROCESS FOR THE PREPARATION OF PHARMACEUTICAL I NTERM EDIATES EGIS GYÓGYSZERGYÁR NYILVÁNOSAN MÜKÖDÖ (HU) 2009-06-04 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 (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-20110040093-A1 PROCESS FOR THE PREPARATION OF PHARMACEUTICAL INTERMEDIATE CYP2F1, CYP4F3, CYP4F11 SLC6A2 2537/4885SLC6A4 2058/4885SLC6A3 1005/4885

“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.