SCHEMBL1682002

SCHEMBL1682002

O=C(CC1(O)CCN(Cc2ccccc2)CC1)c1ccc(F)cc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A12 P48065 1/20 0.53
TMEM97 Q5BJF2 1/20 0.53
MCHR1 Q99705 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 2/20 0.51
DRD2 P14416 1/20 0.51
CYP2D6 P10635 2/20 0.50
MAPK1 P28482 2/20 0.50
CHRM4 P08173 1/20 0.49
CHRM2 P08172 1/20 0.49
CHRM3 P20309 1/20 0.49
CYP3A4 P08684 1/20 0.49
MAPT P10636 1/20 0.49
CYP2C19 P33261 1/20 0.49

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
Bromide SCHEMBL1681802 0.99 SLC6A12 (0.52) SLC6A12TMEM97MCHR1SIGMAR1MEN1
SCHEMBL1681869 0.95 MEN1 (0.52) MEN1KMT2AALDH1A1DRD2CYP2D6
Hydrochloric Acid SCHEMBL1681749 0.94 MEN1 (0.51) SIGMAR1MEN1KMT2AALDH1A1DRD2
SCHEMBL1681970 0.91 ALDH1A1 (0.61) MEN1KMT2AALDH1A1CYP2D6MAPK1
Bromide SCHEMBL1681744 0.89 ALDH1A1 (0.60) MEN1KMT2AALDH1A1CYP2D6MAPK1
Hydrochloric Acid SCHEMBL1681816 0.89 ALDH1A1 (0.60) MEN1KMT2AALDH1A1CYP2D6MAPK1
SCHEMBL1682046 0.88 CCR3 (0.59) SIGMAR1ALDH1A1DRD2CYP2D6MAPK1
Bromide SCHEMBL1681757 0.87 CCR3 (0.58) SIGMAR1ALDH1A1DRD2CYP2D6MAPK1
SCHEMBL15157970 0.86 SIGMAR1 (0.52) SLC6A12TMEM97MCHR1SIGMAR1MEN1
SCHEMBL1682095 0.84 HTR2A (0.52) ALDH1A1CYP2D6MAPK1CHRM2CHRM3

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 SLC6A12 2923/4885TMEM97 3965/4885MCHR1 4798/4885

“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.