SCHEMBL891393

SCHEMBL891393

[CH2]C(O)OCCCCCCCCCCCCCCCCCC

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.48
USP2 O75604 1/20 0.45
HTT P42858 2/20 0.44
MEN1 O00255 1/20 0.41
THRB P10828 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 2/20 0.41
LPAR3 Q9UBY5 7/20 0.41
LPAR1 Q92633 6/20 0.41
LPAR2 Q9HBW0 3/20 0.41
SPHK1 Q9NYA1 1/20 0.40

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
SCHEMBL27541085 1.00 DNM1 (0.48) DNM1USP2HTTMEN1THRB
SCHEMBL27590443 1.00 DNM1 (0.48) DNM1USP2HTTMEN1THRB
SCHEMBL28360257 1.00 DNM1 (0.48) DNM1USP2HTTMEN1THRB
SCHEMBL27731015 1.00 DNM1 (0.48) DNM1USP2HTTMEN1THRB
SCHEMBL27513059 1.00 DNM1 (0.48) DNM1USP2HTTMEN1THRB
SCHEMBL27402460 1.00 DNM1 (0.48) DNM1USP2HTTMEN1THRB
SCHEMBL27422918 0.98
SCHEMBL10934385 0.90
SCHEMBL28282260 0.88 ALDH1A1 (0.56) MEN1KMT2ALPAR3LPAR1LPAR2
SCHEMBL10793957 0.80 DNM1 (0.44) DNM1USP2HTTMEN1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8293220-B2 Hair cosmetic SHISEIDO COMPANY, LTD. (JP) 2012-10-23 US claimed
US-20120082633-A1 Hair Cosmetic SHISEIDO COMPANY, LTD. (JP) 2012-04-05 US claimed

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-20120082633-A1 Hair Cosmetic CUTA, ALKBH2, ACMSD DNM1 2429/4885USP2 816/4885HTT 1920/4885

“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.