SCHEMBL14511635

SCHEMBL14511635

Cc1nc(C(=O)N2CCOCC2)c(-c2ccc(F)cc2)[nH]1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ PIN1 Q13526 1/20 0.46
▸ TSHR P16473 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ MAPK13 O15264 2/20 0.44
▸ MAPK12 P53778 2/20 0.44
▸ MAPK11 Q15759 2/20 0.44
▸ MAPK14 Q16539 2/20 0.44
▸ EPHX2 P34913 1/20 0.43
▸ HPGD P15428 2/20 0.43
▸ GRIN2B Q13224 2/20 0.43
▸ GRM2 Q14416 1/20 0.43
▸ RIPK1 Q13546 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ AKR1C3 P42330 1/20 0.42

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
SCHEMBL14511632 0.80 MEN1 (0.44) RAB9ANPC1PIN1ALDH1A1EPHX2
SCHEMBL14705882 0.76 HAO2 (0.44) PIN1MAPK13MAPK12MAPK11MAPK14
SCHEMBL14511647 0.73 ALDH1A1 (0.44) L3MBTL1PIN1ALDH1A1LMNAHTT
SCHEMBL14511640 0.72 ALOX5 (0.51) RAB9ANPC1ALDH1A1MAPK13MAPK12
SCHEMBL14705875 0.72 SMN1; SMN2 (0.49) RAB9ANPC1L3MBTL1ALDH1A1MAPK13
SCHEMBL8172365 0.71 EPHX2 (0.71) RAB9ANPC1L3MBTL1TSHREPHX2
SCHEMBL14511634 0.71 ALDH1A1 (0.45) L3MBTL1PIN1TSHRALDH1A1LMNA
SCHEMBL14511637 0.70 PIN1 (0.50) L3MBTL1PIN1TSHRALDH1A1HPGD
SCHEMBL5208543 0.69 EPHX2 (0.77) L3MBTL1TSHRALDH1A1EPHX2HPGD
SCHEMBL7991747 0.69 PARP1 (0.53) L3MBTL1PIN1ALDH1A1MAPK13MAPK12

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-20070105900-A1 Pharmaceutical compounds ATEX THERAPEUTICS, LIMITED (GB) 2007-05-10 — — US disclosed
US-20070105900-A1 Pharmaceutical compounds ATEX THERAPEUTICS, LIMITED (GB) 2007-05-10 — — 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-20070105900-A1 Pharmaceutical compounds AURKA, AURKC, CDK1 RAB9A 4050/4885NPC1 1220/4885L3MBTL1 4490/4885

“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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