SCHEMBL23927871

SCHEMBL23927871

CN(C)C(Cn1ccc2cc(OCc3ccccc3)ccc21)OC(=O)/C=C/C(=O)OC(Cn1ccc2cc(OCc3ccccc3)ccc21)N(C)C

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 3/20 0.48
PPARA Q07869 2/20 0.48
SRD5A2 P31213 1/20 0.46
LTB4R Q15722 3/20 0.45
LTB4R2 Q9NPC1 3/20 0.45
HDAC1 Q13547 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
BCL2 P10415 2/20 0.43
MCL1 Q07820 2/20 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
SCHEMBL23927937 0.85 HTR2C (0.53) HDAC1HDAC6
SCHEMBL23927824 0.81 KMT2A (0.44) HDAC1HDAC6MCL1
SCHEMBL30488439 0.80 MEN1 (0.49) PPARDPPARASRD5A2HDAC1HDAC6
SCHEMBL30488430 0.80 MEN1 (0.49) PPARDPPARASRD5A2HDAC1HDAC6
SCHEMBL25421675 0.80 MEN1 (0.49) PPARDPPARASRD5A2HDAC1HDAC6
SCHEMBL25421677 0.80 MEN1 (0.49) PPARDPPARASRD5A2HDAC1HDAC6
SCHEMBL23927913 0.79 LTB4R (0.42) SRD5A2LTB4RLTB4R2BCL2MCL1
SCHEMBL23927929 0.79 HTR2C (0.51) HDAC1HDAC6
SCHEMBL23927907 0.79 HTR2C (0.51) HDAC1HDAC6
SCHEMBL25424003 0.78 MEN1 (0.51) PPARDPPARASRD5A2HDAC1HDAC6

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-11254640-B2 N-substituted indoles and other heterocycles for treating brain disorders THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-02-22 US disclosed
US-20210332012-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA CORPORATION 2021-10-28 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-11254640-B2 N-substituted indoles and other heterocycles for treating brain disorders TPH2, AANAT, HTR2C PPARD 2143/4885PPARA 3009/4885SRD5A2 997/4885
US-20210332012-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS TPH2, AANAT, HTR2C PPARD 2143/4885PPARA 3009/4885SRD5A2 997/4885

“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.