SCHEMBL2486255

SCHEMBL2486255

CCOc1c(Cl)cc(C)nc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
HPGD P15428 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MEN1 O00255 2/20 0.44
RAB9A P51151 2/20 0.44
KMT2A Q03164 2/20 0.44
LMNA P02545 2/20 0.44
NPC1 O15118 1/20 0.44
ABL1 P00519 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
RIN1 Q13671 1/20 0.44
HTT P42858 3/20 0.43
KDM4E B2RXH2 3/20 0.43
CYP1A2 P05177 2/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
POLB P06746 1/20 0.42
ALOX15 P16050 1/20 0.42
PKM P14618 1/20 0.41

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
SCHEMBL2491494 0.85 S1PR4 (0.48) ALDH1A1HPGDSMN1; SMN2MEN1RAB9A
SCHEMBL2533704 0.77 TPMT (0.40) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL22866606 0.74 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL1457769 0.73 PLAU (0.64) ALDH1A1HPGDSMN1; SMN2MEN1RAB9A
SCHEMBL18142979 0.72 TDP1 (0.36) ALDH1A1HPGDSMN1; SMN2MEN1RAB9A
SCHEMBL31336718 0.70 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL27303224 0.70 HTT (0.44) ALDH1A1HPGDSMN1; SMN2MEN1RAB9A
SCHEMBL263251 0.69 HCRTR2 (0.50) ALDH1A1HPGDSMN1; SMN2LMNAGAA
SCHEMBL1062649 0.68 ALDH1A1 (0.40) ALDH1A1HPGDSMN1; SMN2RAB9ANPC1
SCHEMBL14720900 0.68 TDP1 (0.45) ALDH1A1HPGDSMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2379550-A1 PIPERIDINE DERIVATIVES USEFUL AS OREXIN ANTAGONISTS Glaxo Group Limited (GB) 2011-10-26 EP disclosed
US-20110257198-A1 PIPERIDINE DERIVATIVES USEFUL AS OREXIN ANTAGONISTS GLAXO GROUP LIMITED (GB) 2011-10-20 US disclosed
US-20110257198-A1 PIPERIDINE DERIVATIVES USEFUL AS OREXIN ANTAGONISTS GLAXO GROUP LIMITED (GB) 2011-10-20 US disclosed
US-20110257198-A1 PIPERIDINE DERIVATIVES USEFUL AS OREXIN ANTAGONISTS GLAXO GROUP LIMITED (GB) 2011-10-20 US disclosed
WO-2010072722-A1 PIPERIDINE DERIVATIVES USEFUL AS OREXIN ANTAGONISTS GLAXO GROUP LIMITED (GB) 2010-07-01 WO disclosed
WO-2010072722-A1 PIPERIDINE DERIVATIVES USEFUL AS OREXIN ANTAGONISTS GLAXO GROUP LIMITED (GB) 2010-07-01 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-20110257198-A1 PIPERIDINE DERIVATIVES USEFUL AS OREXIN ANTAGONISTS HCRTR2, HCRTR1, VIPR2 ALDH1A1 1507/4885HPGD 732/4885SMN1; SMN2 2062/4885

“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.