SCHEMBL17147641

SCHEMBL17147641

CN(C)CCc1cn(Br)c2c(F)ccc(OCc3ccccc3)c12

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.49
HTR1D P28221 1/20 0.41
TRPM8 Q7Z2W7 1/20 0.41
TAAR1 Q96RJ0 2/20 0.39
HTR6 P50406 3/20 0.38
KDM1A O60341 2/20 0.38
EGFR P00533 1/20 0.36
CCR5 P51681 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
LTB4R Q15722 1/20 0.36
LTB4R2 Q9NPC1 1/20 0.36
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
BLM P54132 1/20 0.35

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
SCHEMBL1163485 0.88 HTR2A (0.50) HTR2AHTR1DTRPM8TAAR1HTR6
SCHEMBL3804876 0.86 HTR2A (0.48) HTR2AHTR1DTRPM8TAAR1HTR6
SCHEMBL1163144 0.86 HTR2A (0.48) HTR2AHTR1DTRPM8TAAR1HTR6
SCHEMBL3182087 0.85 HTR2A (0.47) HTR2AHTR1DTRPM8TAAR1HTR6
SCHEMBL3183284 0.84 HTR2A (0.46) HTR2AHTR1DTRPM8TAAR1HTR6
SCHEMBL3806838 0.84 HTR2A (0.47) HTR2AHTR1DTRPM8TAAR1HTR6
SCHEMBL16509893 0.84 HTR2A (0.47) HTR2AHTR1DTRPM8TAAR1HTR6
SCHEMBL3176490 0.83 HTR6 (0.46) HTR2AHTR1DTRPM8HTR6EGFR
SCHEMBL3167331 0.83 HTR6 (0.46) HTR2AHTR1DTRPM8HTR6EGFR
SCHEMBL17150095 0.83 HTR1A (0.38) HTR2AHTR1DTAAR1HTR6KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150284365-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION (US) 2015-10-08 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-20150284365-A1 COMPOUNDS AND METHODS OF USE THEREOF AANAT, HNMT, INMT HTR2A 34/4885HTR1D 154/4885TRPM8 2766/4885

“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.