SCHEMBL4893550

SCHEMBL4893550

COc1cc(OC(F)(F)F)ccc1C1CCNCC1C

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.47
HTR2A P28223 7/20 0.44
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SSTR1 P30872 2/20 0.40
SSTR4 P31391 2/20 0.40
HTR2C P28335 6/20 0.39
HTR2B P41595 3/20 0.39
HTR1A P08908 1/20 0.39
HTR1D P28221 1/20 0.39
HTR1E P28566 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA2B P29275 1/20 0.39
HTR7 P34969 1/20 0.39
HTR6 P50406 1/20 0.39
RUNX1 Q01196 1/20 0.37

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
SCHEMBL4893547 1.00 TACR1 (0.47) TACR1HTR2AMEN1KMT2ASSTR1
SCHEMBL4893559 1.00 TACR1 (0.47) TACR1HTR2AMEN1KMT2ASSTR1
SCHEMBL4886553 0.85 SSTR1 (0.43) TACR1SSTR1SSTR4HTR2CHTR2B
SCHEMBL4886544 0.85 SSTR1 (0.43) TACR1SSTR1SSTR4HTR2CHTR2B
SCHEMBL4925657 0.85 GRM2 (0.43) TACR1SSTR1SSTR4HTR2C
SCHEMBL4925663 0.85 GRM2 (0.43) TACR1SSTR1SSTR4HTR2C
SCHEMBL4925672 0.85 GRM2 (0.43) TACR1SSTR1SSTR4HTR2C
SCHEMBL4886548 0.85 SSTR1 (0.43) TACR1SSTR1SSTR4HTR2CHTR2B
SCHEMBL4886233 0.84 SSTR1 (0.42) TACR1SSTR1SSTR4HTR2C
SCHEMBL4886238 0.84 SSTR1 (0.42) TACR1SSTR1SSTR4HTR2C

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-20080312271-A1 AZABENZIMIDAZOLYL COMPOUNDS PFIZER INC. 2008-12-18 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-20080312271-A1 AZABENZIMIDAZOLYL COMPOUNDS AZI2, PAICS, UGT2B7 TACR1 1612/4885HTR2A 1378/4885MEN1 812/4885

“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.