SCHEMBL6765129

SCHEMBL6765129

Cc1ccc(S(=O)(=O)Nc2ccccc2)cc1NC(=O)Cc1ccc(C#N)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MGAT2 Q10469 1/20 0.56
LMNA P02545 2/20 0.49
POLB P06746 1/20 0.49
KDM1A O60341 1/20 0.48
GPR27 Q9NS67 2/20 0.47
AVPR2 P30518 1/20 0.47
AR P10275 1/20 0.47
RORC P51449 3/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
IDH2 P48735 1/20 0.46
HPGD P15428 1/20 0.45
BRD4 O60885 1/20 0.45
ATIC P31939 1/20 0.45
CYP19A1 P11511 1/20 0.45
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL6766536 0.90 HDAC1 (0.52) MGAT2LMNAKDM1AGPR27AR
SCHEMBL6571783 0.85 LMNA (0.51) MGAT2LMNAPOLBKDM1ARORC
SCHEMBL6762133 0.84 POLB (0.53) LMNAPOLBKDM1AARRORC
SCHEMBL24254519 0.83 MGAT2 (0.57) MGAT2LMNAPOLBGPR27HDAC1
SCHEMBL6569935 0.83 MCL1 (0.49) LMNAPOLBKDM1ARORCHDAC1
SCHEMBL6571948 0.83 HDAC1 (0.48) LMNAPOLBKDM1AGPR27AR
SCHEMBL6762119 0.83 TMPRSS6 (0.57) MGAT2LMNAPOLBHDAC1HDAC8
SCHEMBL24254503 0.82 MGAT2 (0.54) MGAT2LMNAGPR27ALDH1A1
SCHEMBL6574016 0.81 HDAC1 (0.51) LMNAKDM1AGPR27ARRORC
SCHEMBL6574325 0.80 LMNA (0.44) LMNAKDM1ARORCHPGDBRD4

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 MGAT2 566/4885LMNA 1447/4885POLB 4091/4885

“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.