SCHEMBL18428792

SCHEMBL18428792

OCCOCCOCCOCCOCCO[C@H]1CC[C@H](N(Cc2ccccc2)Cc2ccccc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
YTHDC1 Q96MU7 1/20 0.40
ACKR3 P25106 1/20 0.38
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 1/20 0.37
KMT2A Q03164 5/20 0.36
MEN1 O00255 4/20 0.34
GRIN2B Q13224 1/20 0.34
RAB9A P51151 1/20 0.34
ALDH1A1 P00352 1/20 0.34
FOXM1 Q08050 1/20 0.34
KDM4E B2RXH2 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CCR5 P51681 1/20 0.33
LIPG Q9Y5X9 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
SCHEMBL18365044 1.00 YTHDC1 (0.40) YTHDC1ACKR3SLC6A2SLC6A4SLC6A3
SCHEMBL18428790 1.00 YTHDC1 (0.40) YTHDC1ACKR3SLC6A2SLC6A4SLC6A3
SCHEMBL18428842 0.92 YTHDC1 (0.44) YTHDC1ACKR3SLC6A2SLC6A4SLC6A3
SCHEMBL15029587 0.92 YTHDC1 (0.44) YTHDC1ACKR3SLC6A2SLC6A4SLC6A3
SCHEMBL15009795 0.86 YTHDC1 (0.42) YTHDC1ACKR3SLC6A2SLC6A4SLC6A3
SCHEMBL15009794 0.86 YTHDC1 (0.42) YTHDC1ACKR3SLC6A2SLC6A4SLC6A3
SCHEMBL29696509 0.85 ADRB2 (0.43) YTHDC1SLC6A2SLC6A4SLC6A3KMT2A
SCHEMBL25030365 0.84 KDM4E (0.41) KMT2AMEN1ALDH1A1KDM4EHSD17B10
SCHEMBL30590135 0.84 KDM4E (0.41) KMT2AMEN1ALDH1A1KDM4EHSD17B10
SCHEMBL5009994 0.82 YTHDC1 (0.43) YTHDC1ACKR3SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220162163-A1 ALANINE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2022-05-26 US disclosed
US-20170037004-A1 ALANINE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2017-02-09 US disclosed
US-20170037004-A1 ALANINE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2017-02-09 US disclosed
US-20170037004-A1 ALANINE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2017-02-09 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 (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-20220162163-A1 ALANINE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE XIAP, BIRC3, BIRC2 YTHDC1 4097/4885ACKR3 4366/4885SLC6A2 4185/4885
US-20170037004-A1 ALANINE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE XIAP, BIRC3, BIRC2 YTHDC1 4097/4885ACKR3 4366/4885SLC6A2 4185/4885

“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.