SCHEMBL1757795

SCHEMBL1757795

Cc1[nH]c2ccc(F)cc2c1-c1nnc(Cl)c2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
HTR7 P34969 1/20 0.43
HTR6 P50406 1/20 0.43
LMNA P02545 1/20 0.42
PTGS2 P35354 1/20 0.41
GAA P10253 3/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
GLA P06280 1/20 0.40
HTT P42858 1/20 0.40
MGAM O43451 2/20 0.40
SI P14410 2/20 0.40
MGAM2 Q2M2H8 2/20 0.40
MAP3K14 Q99558 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
CSF1R P07333 1/20 0.38
GSK3B P49841 1/20 0.38
KIF11 P52732 1/20 0.38

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
SCHEMBL1757776 0.87 MAP3K14 (0.52) HTR2AHTR2CHTR7HTR6LMNA
SCHEMBL1757957 0.87 LMNA (0.44) HTR6LMNAPTGS2KDM4EALDH1A1
SCHEMBL1757888 0.85 LMNA (0.56) HTR2AHTR2CHTR6LMNAGAA
SCHEMBL1757976 0.82 MEN1 (0.49) HTR2AHTR2CHTR7HTR6LMNA
SCHEMBL1757489 0.77 MAP2 (0.41) LMNAKDM4EALDH1A1MAP3K14MAPT
SCHEMBL2961511 0.74 HTR7 (0.43) HTR2AHTR2CHTR7HTR6LMNA
SCHEMBL27681973 0.73 PTGS2 (0.59) HTR2AHTR2CHTR7HTR6LMNA
SCHEMBL1757597 0.72 LMNA (0.66) HTR2AHTR2CHTR7HTR6LMNA
SCHEMBL1757305 0.72 PTGDR2 (0.34) PTGS2MAP2
SCHEMBL2961347 0.69 PTGDR2 (0.44) HTR2AHTR2CHTR7HTR6LMNA

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-20110105509-A1 INDOLE BASED RECEPTOR CRTH2 ANTAGONISTS WYETH, LLC (US) 2011-05-05 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-20110105509-A1 INDOLE BASED RECEPTOR CRTH2 ANTAGONISTS HRH2, CRHR2, CRHR1 HTR2A 59/4885HTR2C 146/4885HTR7 117/4885

“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.