SCHEMBL24913482

SCHEMBL24913482

CC(C)(C)OC(=O)NCCc1c[nH]c2cc(OCC3CC3)ccc12

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 5/20 0.53
MTNR1B P49286 3/20 0.53
MAPT P10636 3/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 1/20 0.46
TRPV1 Q8NER1 1/20 0.46
HPGD P15428 1/20 0.46
MAPK1 P28482 1/20 0.46
LTA4H P09960 2/20 0.45
PLA2G2A P14555 2/20 0.45
TRPM8 Q7Z2W7 1/20 0.44
GAA P10253 1/20 0.44
KDM4E B2RXH2 1/20 0.44
FAAH O00519 2/20 0.43
CAPN1 P07384 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
SCHEMBL2538065 0.87 MTNR1A (0.57) MTNR1AMTNR1BMAPTMEN1KMT2A
SCHEMBL2536092 0.85 MTNR1A (0.55) MTNR1AMTNR1BMAPTMEN1KMT2A
SCHEMBL30961937 0.83 SCN9A (0.51) MAPT
SCHEMBL2532851 0.82 TRPM8 (0.66) MTNR1AMTNR1BMAPTMEN1KMT2A
SCHEMBL13285078 0.80 MTNR1A (0.56) MTNR1AMTNR1BMAPTMEN1KMT2A
SCHEMBL2534000 0.80 TYR (0.62) MTNR1AMTNR1BMAPTALDH1A1TRPV1
SCHEMBL8957539 0.79 TRPV1 (0.57) MTNR1AMTNR1BMAPTMEN1KMT2A
SCHEMBL397159 0.79 MTNR1A (0.52) MTNR1AMTNR1BMAPTMEN1KMT2A
SCHEMBL2540619 0.79 MTNR1A (0.57) MTNR1AMTNR1BMEN1KMT2ATRPV1
SCHEMBL2363493 0.79 MTNR1A (0.52) MTNR1AMTNR1BMAPTMEN1KMT2A

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-20240208932-A1 ARYLAMINO DERIVATIVE ESTROGEN RECEPTOR MODULATOR AND USE THEREOF XIZANG HAISCO PHARMACEUTICAL CO., LTD. (CN) 2024-06-27 US disclosed
WO-2023284837-A1 ARYLAMINO DERIVATIVE ESTROGEN RECEPTOR MODULATOR AND USE THEREOF 四川海思科制药有限公司 2023-01-19 WO 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-20240208932-A1 ARYLAMINO DERIVATIVE ESTROGEN RECEPTOR MODULATOR AND USE THEREOF GPER1, ESR1, ESRRA MTNR1A 63/4885MTNR1B 90/4885MAPT 2985/4885

“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.