SCHEMBL23789901

SCHEMBL23789901

CCNCc1ccc(OC)cc1OCCCC(=O)OC

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 1/20 0.51
▸ MAPT P10636 1/20 0.46
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ CNR1 P21554 2/20 0.44
▸ CNR2 P34972 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ HDAC3 O15379 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC2 Q92769 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ MTNR1A P48039 1/20 0.42
▸ MTNR1B P49286 1/20 0.42
▸ TSHR P16473 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ PPARD Q03181 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
SCHEMBL21601644 0.90 APLNR (0.51) APLNRMEN1KMT2ACNR1CNR2
SCHEMBL23001571 0.82 APLNR (0.56) APLNRMEN1KMT2ACNR1CNR2
SCHEMBL31155834 0.79 MEN1 (0.48) MAPTMEN1KMT2ACNR1CNR2
SCHEMBL12522890 0.78 APLNR (0.83) APLNRMEN1KMT2AALDH1A1HDAC3
SCHEMBL24851928 0.78 APLNR (0.67) APLNRMEN1KMT2AALDH1A1HDAC3
SCHEMBL23789919 0.76 APLNR (0.44) APLNRMEN1KMT2ACNR1CNR2
SCHEMBL14566055 0.76 MAPT (0.52) MAPTCNR1CNR2HDAC3HDAC1
SCHEMBL3991925 0.75 MAPT (0.55) MAPTMEN1KMT2ACNR1CNR2
SCHEMBL1269158 0.74 APLNR (0.71) APLNRMEN1KMT2ACNR1CNR2
SCHEMBL14957586 0.74 APLNR (0.57) APLNRMAPTMEN1KMT2ACNR1

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-20210277051-A1 COMPOUND OR SALT THEREOF AND PREPARATION METHOD AND APPLICATION OF SAME ZHEJIANG PEPTITES BIOTECH CO., LTD (CN) 2021-09-09 — — 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-20210277051-A1 COMPOUND OR SALT THEREOF AND PREPARATION METHOD AND APPLICATION OF SAME SEM1, REN, SETDB1 APLNR 3444/4885MAPT 2495/4885MEN1 537/4885

“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.

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