SCHEMBL1681966

SCHEMBL1681966

CC(=O)Nc1ccc(CN2CCC(O)(CC(=O)c3ccccc3)CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.58
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
ALDH1A1 P00352 3/20 0.56
KDM4E B2RXH2 1/20 0.56
OPRM1 P35372 1/20 0.54
OPRD1 P41143 1/20 0.54
GRIN2B Q13224 1/20 0.49
RAB9A P51151 2/20 0.49
TP53 P04637 2/20 0.49
POLB P06746 1/20 0.49
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CCR5 P51681 1/20 0.47
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HIF1A Q16665 1/20 0.46
BTK Q06187 1/20 0.46

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
Hydrochloric Acid SCHEMBL1681887 0.99 MEN1 (0.57) NPC1MEN1KMT2AALDH1A1KDM4E
SCHEMBL8132361 0.95 MEN1 (0.55) NPC1MEN1KMT2AALDH1A1KDM4E
SCHEMBL1681984 0.86 KMT2A (0.55) NPC1MEN1KMT2AALDH1A1KDM4E
SCHEMBL1681970 0.85 ALDH1A1 (0.61) MEN1KMT2AALDH1A1KDM4EPOLB
Hydrochloric Acid SCHEMBL1809984 0.85 KMT2A (0.54) NPC1MEN1KMT2AALDH1A1KDM4E
Bromide SCHEMBL1681744 0.84 ALDH1A1 (0.60) MEN1KMT2AALDH1A1KDM4EPOLB
Hydrochloric Acid SCHEMBL1681816 0.84 ALDH1A1 (0.60) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL1681956 0.83 CCR3 (0.56) ALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL1682096 0.82 ALDH1A1 (0.51) MEN1KMT2AALDH1A1KDM4EPOLB
Hydrochloric Acid SCHEMBL1682022 0.82 CCR3 (0.54) ALDH1A1POLBHTTSMN1; SMN2L3MBTL1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8501778-B2 Aralkyl piperidine derivatives and their uses as antalgic or ataractic agent NHWA PHARMA. CORPORATION (CN) 2013-08-06 US claimed
EP-2305645-B1 ARALKYL PIPERIDINE DERIVATIVES AND THEIR USES AS ANTALGIC OR ATARACTIC AGENT NHWA PHARMA CORP (CN) 2012-05-16 EP claimed
US-20110105503-A1 ARALKYL PIPERIDINE DERIVATIVES AND THEIR USES AS ANTALGIC OR ATARACTIC AGENT NHWA PHARMA. CORPORATION (CN) 2011-05-05 US claimed
EP-2305645-A1 ARALKYL PIPERIDINE DERIVATIVES AND THEIR USES AS ANTALGIC OR ATARACTIC AGENT NHWA Pharma.corporation (CN) 2011-04-06 EP claimed
US-8501778-B2 Aralkyl piperidine derivatives and their uses as antalgic or ataractic agent NHWA PHARMA. CORPORATION (CN) 2013-08-06 US disclosed
EP-2305645-B1 ARALKYL PIPERIDINE DERIVATIVES AND THEIR USES AS ANTALGIC OR ATARACTIC AGENT NHWA PHARMA CORP (CN) 2012-05-16 EP disclosed
US-20110105503-A1 ARALKYL PIPERIDINE DERIVATIVES AND THEIR USES AS ANTALGIC OR ATARACTIC AGENT NHWA PHARMA. CORPORATION (CN) 2011-05-05 US disclosed
EP-2305645-A1 ARALKYL PIPERIDINE DERIVATIVES AND THEIR USES AS ANTALGIC OR ATARACTIC AGENT NHWA Pharma.corporation (CN) 2011-04-06 EP 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-20110105503-A1 ARALKYL PIPERIDINE DERIVATIVES AND THEIR USES AS ANTALGIC OR ATARACTIC AGENT ADK, AAK1, ATAD5 NPC1 3505/4885MEN1 4294/4885KMT2A 1246/4885

“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.