SCHEMBL5630445

SCHEMBL5630445

CC1CN(C)CCN1c1cc(C(F)(F)F)ccc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.47
HTR2A P28223 4/20 0.41
HTR2C P28335 3/20 0.41
HTR2B P41595 3/20 0.41
FFAR4 Q5NUL3 1/20 0.40
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
HTR1A P08908 3/20 0.37
DRD2 P14416 2/20 0.37
HTR7 P34969 1/20 0.37
HTR6 P50406 1/20 0.37
MCHR1 Q99705 2/20 0.37
ALDH1A1 P00352 4/20 0.36
MAPT P10636 3/20 0.36
MAPK1 P28482 3/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 3/20 0.36
FPR2 P25090 2/20 0.36
TP53 P04637 2/20 0.36

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
SCHEMBL5630437 1.00 TRPV4 (0.47) TRPV4HTR2AHTR2CHTR2BFFAR4
SCHEMBL5631583 1.00 TRPV4 (0.47) TRPV4HTR2AHTR2CHTR2BFFAR4
Trifluoroacetic Acid SCHEMBL5633024 0.91 FFAR4 (0.47) TRPV4FFAR4CHRM1CHRM3KCNH2
SCHEMBL5632704 0.89 TRPV4 (0.47) TRPV4HTR2AHTR2CHTR2BKMT2A
SCHEMBL5632708 0.89 TRPV4 (0.47) TRPV4HTR2AHTR2CHTR2BKMT2A
SCHEMBL5633568 0.89 TRPV4 (0.47) TRPV4HTR2AHTR2CHTR2BKMT2A
SCHEMBL5632563 0.86 TRPV4 (0.43) TRPV4HTR2AHTR2CHTR2BKMT2A
SCHEMBL5630613 0.86 TRPV4 (0.43) TRPV4HTR2AHTR2CHTR2BKMT2A
SCHEMBL5631899 0.86 TRPV4 (0.43) TRPV4HTR2AHTR2CHTR2BKMT2A
Trifluoroacetic Acid SCHEMBL5632815 0.81 TRPV4 (0.44) TRPV4FFAR4ALDH1A1LMNACHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070179155-A1 N-phenyl-piperazine derivatives and methods of prophylaxis or treatment of 5ht2c receptor associated diseases ARENA PHARMACEUTICALS, INC. 2007-08-02 US disclosed
CN-1809545-A N-phenyl-piperazine derivatives and methods of prophylaxis or treatment of 5HT2c ARENA PHARM INC (US) 2006-07-26 CN 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-20070179155-A1 N-phenyl-piperazine derivatives and methods of prophylaxis or treatment of 5ht2c receptor associated diseases HTR2C, HTR2A, HTR5A TRPV4 946/4885HTR2A 2/4885HTR2C 1/4885

“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.