SCHEMBL16490258

SCHEMBL16490258

CCN(Cc1ccccc1)c1ccc(C(c2ccc(N(CC)Cc3cccc(S(=O)(=O)O)c3)cc2)c2ccc(O)cc2S(=O)(=O)O)cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
APEX1 P27695 1/20 0.42
RECQL P46063 1/20 0.42
BLM P54132 1/20 0.42
CNR2 P34972 12/20 0.41
CNR1 P21554 8/20 0.41
ESRRG P62508 1/20 0.39
TSHR P16473 1/20 0.39
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36

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
SCHEMBL15304550 0.97 THRB (0.44) THRBMEN1KMT2ATDP1APEX1
SCHEMBL16490256 0.90 THRB (0.45) THRBMEN1KMT2ATDP1APEX1
SCHEMBL10606320 0.89 CNR2 (0.48) THRBMEN1KMT2ATDP1APEX1
SCHEMBL8853777 0.88 THRB (0.46) THRBMEN1KMT2ATDP1APEX1
SCHEMBL19650671 0.86 CNR2 (0.52) THRBMEN1KMT2ATDP1APEX1
SCHEMBL18719339 0.84 THRB (0.47) THRBMEN1KMT2ATDP1APEX1
SCHEMBL14499815 0.82 THRB (0.53) THRBMEN1KMT2ATDP1APEX1
SCHEMBL18719346 0.82 CNR2 (0.46) MEN1KMT2ATDP1CNR2CNR1
SCHEMBL18719349 0.82 CNR2 (0.46) CNR2CNR1TSHRNR1H2NR1H3
SCHEMBL18733989 0.82 THRB (0.48) THRBMEN1KMT2ATDP1APEX1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9364403-B2 Hair treatment methods PERACHEM LIMITED (GB) 2016-06-14 US disclosed
US-9320695-B2 Hair treatment methods PERACHEM LIMITED (GB) 2016-04-26 US disclosed
US-20150068548-A1 Hair Treatment Methods HSNF LIMITED (GB) 2015-03-12 US disclosed
US-20150047131-A1 Hair Treatment Methods HSNF LIMITED (GB) 2015-02-19 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-20150068548-A1 Hair Treatment Methods TST, OAT, SLC14A1 THRB 2423/4885MEN1 3002/4885KMT2A 2377/4885
US-20150047131-A1 Hair Treatment Methods POLR1C, SHH, DNMT3A THRB 2412/4885MEN1 2294/4885KMT2A 372/4885

“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.