SCHEMBL6786478

SCHEMBL6786478

CC(C)(C(=O)O)c1ccc(C(=O)CCCN2CCC(c3cn(CC4CC4)c4ccccc34)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2J2 P51589 5/20 0.49
HRH2 P25021 10/20 0.48
DRD2 P14416 3/20 0.47
HTR6 P50406 2/20 0.47
HTR2A P28223 2/20 0.47
HTR2C P28335 2/20 0.47
HTR2B P41595 2/20 0.47
NPC1 O15118 1/20 0.47
MLNR O43193 1/20 0.47
NR1I2 O75469 1/20 0.47
EGFR P00533 1/20 0.47
LMNA P02545 1/20 0.47
ERBB2 P04626 1/20 0.47
FYN P06241 1/20 0.47
CHRM2 P08172 1/20 0.47
CHRM4 P08173 1/20 0.47
ABCB1 P08183 1/20 0.47
ADRB1 P08588 1/20 0.47
HTR1A P08908 1/20 0.47
CHRM5 P08912 1/20 0.47

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
SCHEMBL6785790 0.88 HRH2 (0.49) CYP2J2HRH2DRD2HTR6HTR2A
SCHEMBL6785347 0.87 HRH2 (0.65) HRH2HTR2AHTR2CHTR2B
SCHEMBL7706920 0.82 HRH2 (0.49) HRH2DRD2HTR6HTR2AHTR2C
SCHEMBL6779379 0.80 CCR2 (0.58) CYP2J2DRD2HTR2AADRA1DSLC6A4
SCHEMBL12022081 0.76 CYP2J2 (0.59) CYP2J2HRH2DRD2HTR6HTR2A
SCHEMBL11784884 0.75 DRD2 (0.65) DRD2HTR2AHTR2CHTR2BMLNR
SCHEMBL1395734 0.75 CYP2J2 (0.84) CYP2J2DRD2HTR2AHTR2BLMNA
SCHEMBL6776087 0.75 LMNA (0.59) CYP2J2HRH2DRD2HTR6HTR2A
Hydrochloric Acid SCHEMBL11785189 0.74 DRD2 (0.64) DRD2HTR2AHTR2CHTR2BMLNR
SCHEMBL6786077 0.74 HRH2 (0.63) HRH2HTR2AHTR2CHTR2B

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-1183251-B1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS ALMIRALL PRODESFARMA SA (ES) 2004-02-11 EP claimed
US-6683096-B2 Indolylpiperidine derivatives as antihistaminic and antiallergic agents ALMIRALL PRODESFARMA, S.A. (ES) 2004-01-27 US claimed
US-20020147344-A1 Indolylpiperidine derivatives as antihistaminic and antiallergic agents ALMIRALL PRODESFARMA, S.A. (ES) 2002-10-10 US claimed
EP-1183251-B1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS ALMIRALL PRODESFARMA SA (ES) 2004-02-11 EP disclosed
US-6683096-B2 Indolylpiperidine derivatives as antihistaminic and antiallergic agents ALMIRALL PRODESFARMA, S.A. (ES) 2004-01-27 US disclosed
US-20020147344-A1 Indolylpiperidine derivatives as antihistaminic and antiallergic agents ALMIRALL PRODESFARMA, S.A. (ES) 2002-10-10 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-20020147344-A1 Indolylpiperidine derivatives as antihistaminic and antiallergic agents HRH2, HRH1, HRH4 CYP2J2 208/4885HRH2 1/4885DRD2 79/4885

“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.