SCHEMBL9944108

SCHEMBL9944108

Cc1c(Cl)cc(C(=O)Nc2ccc(C(=O)O)cc2)cc1OCC1CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 3/20 0.50
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
POLB P06746 2/20 0.47
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
MCL1 Q07820 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
PDE4B Q07343 6/20 0.47
PDE4D Q08499 5/20 0.46
PDE4A P27815 4/20 0.46
PDE4C Q08493 4/20 0.46
ABCB11 O95342 1/20 0.46
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PKM P14618 1/20 0.43

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
SCHEMBL9944111 0.90 NR1H4 (0.47) NR1H4MEN1KMT2APOLBLMNA
SCHEMBL9944109 0.87 KMT2A (0.47) NR1H4MEN1KMT2APDE4BPDE4D
SCHEMBL1458529 0.86 MEN1 (0.56) NR1H4MEN1KMT2APOLBLMNA
SCHEMBL1458001 0.85 NR1H4 (0.55) NR1H4MEN1KMT2APOLBLMNA
SCHEMBL9944114 0.82 MEN1 (0.48) MEN1KMT2APOLBLMNAGAA
SCHEMBL9944107 0.81 PDE4A (0.54) PDE4BPDE4DPDE4APDE4CPKM
SCHEMBL9944103 0.80 MAPT (0.50) MEN1KMT2APOLBLMNAGAA
SCHEMBL9944134 0.79 MEN1 (0.58) MEN1KMT2ANPC1RAB9APKM
SCHEMBL9944112 0.79 MEN1 (0.49) MEN1KMT2APOLBLMNAGAA
SCHEMBL1458652 0.78 RAB9A (0.52) NR1H4MEN1KMT2APOLBLMNA

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
US-9447028-B2 Therapeutic aryl-amido-aryl compounds and their use KING'S COLLEGE LONDON (GB) 2016-09-20 US disclosed
US-20160039747-A1 Therapeutic Aryl-Amido-Aryl Compounds and Their Use KING'S COLLEGE LONDON (GB) 2016-02-11 US disclosed
US-20120149737-A1 Therapeutic Aryl-Amido-Aryl Compounds and Their Use KING'S COLLEGE LONDON (GB) 2012-06-14 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 (2 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-20120149737-A1 Therapeutic Aryl-Amido-Aryl Compounds and Their Use RARA, RARB, RARG NR1H4 33/4885MEN1 4809/4885KMT2A 1418/4885
US-20160039747-A1 Therapeutic Aryl-Amido-Aryl Compounds and Their Use RARA, RARB, RARG NR1H4 33/4885MEN1 4809/4885KMT2A 1418/4885

“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.