SCHEMBL7005686

SCHEMBL7005686

O=C1C2CCCC(C(=O)N1Cc1ccc(F)cc1)N2C(=O)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
HTR2C P28335 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
MT-CO2 P00403 1/20 0.41
ALOX5 P09917 1/20 0.41
CACNA1G O43497 1/20 0.41
CACNA1H O95180 1/20 0.41
CACNA1I Q9P0X4 1/20 0.41
TP53 P04637 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL3932386 0.80 HTR2C (0.53) HTR2CSMN1; SMN2NPC1RAB9ACACNA1G
SCHEMBL6629621 0.80 HTR2C (0.45) HTR2CMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL6630038 0.79 HTR2C (0.44) ALDH1A1HTR2CSMN1; SMN2NPC1RAB9A
SCHEMBL6629318 0.76 HTR2C (0.51) HTR2CMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL6625379 0.76 KCNH2 (0.43) ALDH1A1HTR2CMEN1KMT2A
SCHEMBL31295228 0.72 HTR2C (0.50) HTR2CSMN1; SMN2NPC1RAB9A
SCHEMBL14336080 0.71 HTR2C (0.57) HTR2CMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL15436112 0.71 HTR2C (0.46) HTR2CSMN1; SMN2NPC1RAB9ACACNA1G
SCHEMBL1766231 0.71 HTR2C (0.60) HTR2CMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL20353635 0.70 FAAH (0.60) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1326867-A2 BRIDGED PIPERAZINE DERIVATIVES Pfizer Products Inc. (US) 2003-07-16 EP disclosed
US-20020119961-A1 Bridged piperazine derivatives PFIZER INC. 2002-08-29 US disclosed
WO-2002032901-A2 BRIDGED PIPERAZINE DERIVATIVES PFIZER PRODUCTS INC. (US) 2002-04-25 WO 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-20020119961-A1 Bridged piperazine derivatives MYD88, IL4, ARG1 ALDH1A1 772/4885HTR2C 3590/4885MEN1 4425/4885

“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.