SCHEMBL6764618

SCHEMBL6764618

Cc1cc(C)c(NS(=O)(=O)Cc2ccccc2)cc1NC(=O)Cc1ccc(C#N)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RORC P51449 3/20 0.47
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47
POLB P06746 1/20 0.44
IDO1 P14902 1/20 0.43
EGLN2 Q96KS0 1/20 0.43
MAPT P10636 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PARP14 Q460N5 1/20 0.41
GALR3 O60755 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
ACLY P53396 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
SCHEMBL6569935 0.87 MCL1 (0.49) RORCLMNAHPGDPOLBIDO1
SCHEMBL6762058 0.83 F2 (0.54) HPGDPOLB
SCHEMBL6570560 0.80 F2 (0.45) RORCLMNAPOLBIDO1SMN1; SMN2
SCHEMBL6766536 0.77 HDAC1 (0.52) RORCLMNAHPGDMAPT
SCHEMBL6765129 0.77 MGAT2 (0.56) RORCLMNAHPGDPOLB
SCHEMBL6762133 0.77 POLB (0.53) RORCLMNAHPGDPOLB
SCHEMBL12700241 0.76 HPGD (0.70) RORCLMNAHPGDMAPTSMN1; SMN2
SCHEMBL6571948 0.74 HDAC1 (0.48) RORCLMNAHPGDPOLBIDO1
SCHEMBL6570647 0.74 MCL1 (0.54) RORCLMNAHPGDIDO1MAPT
SCHEMBL31616031 0.73 ACLY (0.60) HPGDACLY

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-20040248897-A1 Substituted N-acylaniline derivatives, the preparation thereof, and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-12-09 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-20040248897-A1 Substituted N-acylaniline derivatives, the preparation thereof, and their use as pharmaceutical compositions NAT1, CYP3A5, CYP3A7 RORC 1596/4885LMNA 1447/4885HPGD 2121/4885

“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.