SCHEMBL2892583

SCHEMBL2892583

CC(=O)Nc1cc2c(cc1Nc1ccccc1Oc1ccc(Cl)cc1)OC(C)O2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNLIP P16233 5/20 0.41
L3MBTL1 Q9Y468 4/20 0.40
TDP1 Q9NUW8 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 2/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
HPGD P15428 1/20 0.40
MAPT P10636 2/20 0.39
ESRRA P11474 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
PTK2 Q05397 1/20 0.38
ALOX12 P18054 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
GPR55 Q9Y2T6 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL16316797 0.80 L3MBTL1 (0.56) L3MBTL1TDP1SMN1; SMN2MEN1KMT2A
SCHEMBL2893274 0.78 PTGDR2 (0.47) PNLIPL3MBTL1TDP1SMN1; SMN2MEN1
SCHEMBL2892667 0.74 GAA (0.47) PNLIPL3MBTL1TDP1SMN1; SMN2MEN1
SCHEMBL2888429 0.73 ESRRA (0.46) PNLIPL3MBTL1TDP1SMN1; SMN2MEN1
SCHEMBL2884687 0.73 L3MBTL1 (0.44) PNLIPL3MBTL1TDP1SMN1; SMN2MEN1
SCHEMBL2892435 0.72 L3MBTL1 (0.55) PNLIPL3MBTL1TDP1SMN1; SMN2MEN1
SCHEMBL2892580 0.72 RAB9A (0.47) L3MBTL1TDP1SMN1; SMN2MEN1KMT2A
SCHEMBL2885405 0.71 L3MBTL1 (0.45) PNLIPL3MBTL1TDP1SMN1; SMN2MEN1
SCHEMBL2888605 0.71 HTR2A (0.51) L3MBTL1TDP1SMN1; SMN2MEN1KMT2A
SCHEMBL2888424 0.70 HTR2A (0.45) L3MBTL1TDP1SMN1; SMN2MEN1KMT2A

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-8558028-B2 Compound capable of inhibiting 17-beta hydroxysteriod dehydrogenase UNIVERSITY OF BATH OF CLAVERTON DOWN (GB) 2013-10-15 US disclosed
US-20100286204-A1 COMPOUND CAPABLE OF INHIBITING 17-BETA HYDROXYSTERIOD DEHYDROGENASE STERIX LIMITED (GB) 2010-11-11 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-20100286204-A1 COMPOUND CAPABLE OF INHIBITING 17-BETA HYDROXYSTERIOD DEHYDROGENASE HSD17B13, HSD17B3, HSD3B2 PNLIP 2520/4885L3MBTL1 2881/4885TDP1 3964/4885

“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.