SCHEMBL21880702

SCHEMBL21880702

CNCCCCCCNC(C)C

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.50
SIGMAR1 Q99720 2/20 0.41
HRH4 Q9H3N8 2/20 0.40
HRH3 Q9Y5N1 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.33
KISS1R Q969F8 1/20 0.33
MAPT P10636 1/20 0.32
ADRB2 P07550 1/20 0.32
PAOX Q6QHF9 1/20 0.32
HTR2A P28223 1/20 0.32
HRH1 P35367 1/20 0.32
GRIA1 P42261 1/20 0.32

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
SCHEMBL22458762 1.00 EPHX1 (0.50) EPHX1SIGMAR1HRH4HRH3L3MBTL1
SCHEMBL18458888 1.00 EPHX1 (0.50) EPHX1SIGMAR1HRH4HRH3L3MBTL1
SCHEMBL23841891 1.00 EPHX1 (0.50) EPHX1SIGMAR1HRH4HRH3L3MBTL1
SCHEMBL11293486 0.97 EPHX1 (0.46) EPHX1SIGMAR1HRH4HRH3L3MBTL1
SCHEMBL8222606 0.92
SCHEMBL754871 0.88 HRH4 (0.45) EPHX1SIGMAR1HRH4HRH3ADRB2
SCHEMBL841330 0.88 HRH4 (0.45) EPHX1SIGMAR1HRH4HRH3ADRB2
SCHEMBL4789143 0.88 HRH4 (0.45) EPHX1SIGMAR1HRH4HRH3ADRB2
SCHEMBL19350614 0.88 HRH4 (0.45) EPHX1SIGMAR1HRH4HRH3ADRB2
SCHEMBL2479475 0.88 HRH4 (0.45) EPHX1SIGMAR1HRH4HRH3ADRB2

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-20210128607-A1 POLYMER-CONJUGATED METAP2 INHIBITORS, AND THERAPEUTIC METHODS OF USE THEREOF SYNDEVRX, INC. 2021-05-06 US disclosed
US-10588904-B2 METAP2 inhibitors and methods of treating obesity SYNDEVRX, INC. (US) 2020-03-17 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-10588904-B2 METAP2 inhibitors and methods of treating obesity METAP2, ADIPOR2, METAP1 EPHX1 3359/4885SIGMAR1 4814/4885HRH4 4730/4885
US-20210128607-A1 POLYMER-CONJUGATED METAP2 INHIBITORS, AND THERAPEUTIC METHODS OF USE THEREOF METAP2, MTX2, METAP1 EPHX1 2549/4885SIGMAR1 4435/4885HRH4 4117/4885

“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.