SCHEMBL22481360

SCHEMBL22481360

CCCCC(C)(C)C(=O)OCc1ccc(NC(C)(CC)CC)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.39
HPGD P15428 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TBXAS1 P24557 1/20 0.36
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
ALDH1A1 P00352 3/20 0.34
CYP3A4 P08684 2/20 0.34
TSHR P16473 2/20 0.34
MAPK1 P28482 1/20 0.34
MBOAT4 Q96T53 1/20 0.33
NAAA Q02083 1/20 0.33
ASAH1 Q13510 1/20 0.33
ROCK2 O75116 1/20 0.33

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
SCHEMBL23899582 0.82 KMT2A (0.42) ELANEHPGDNPC1RAB9AMEN1
SCHEMBL22314998 0.82 KMT2A (0.40) ELANEHPGDRAB9AMEN1KMT2A
SCHEMBL27312244 0.81 CYP4F2 (0.44) ELANEHPGDNPC1RAB9AMEN1
SCHEMBL21653412 0.81 MBOAT4 (0.37) ELANEHPGDNPC1RAB9AMEN1
SCHEMBL22812898 0.79 ALDH1A1 (0.52) ELANEKMT2AL3MBTL1SMN1; SMN2TDP1
SCHEMBL18646461 0.79 KMT2A (0.38) ELANEHPGDNPC1RAB9AMEN1
SCHEMBL26740077 0.79 HPGD (0.36) HPGDNPC1RAB9AMEN1KMT2A
SCHEMBL20801346 0.78 ALDH1A1 (0.43) HPGDNPC1RAB9AMEN1KMT2A
SCHEMBL26741305 0.77 ELANE (0.42) ELANEHPGDNPC1RAB9AMEN1
SCHEMBL21153420 0.77 KMT2A (0.42) ELANEHPGDNPC1RAB9AMEN1

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-10940178-B2 Weekly dosing regimens for anti-CD30 vc-PAB-MMAE antibody drug-conjugates SEAGEN INC. (US) 2021-03-09 US disclosed
US-20200306336-A1 WEEKLY DOSING REGIMENS FOR ANTI-CD30 VC-PAB-MMAE ANTIBODY DRUG-CONJUGATES SEATTLE GENETICS, INC. (US) 2020-10-01 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-10940178-B2 Weekly dosing regimens for anti-CD30 vc-PAB-MMAE antibody drug-conjugates CD44, PABPC1, CD47 ELANE 3843/4885HPGD 4819/4885NPC1 3498/4885
US-20200306336-A1 WEEKLY DOSING REGIMENS FOR ANTI-CD30 VC-PAB-MMAE ANTIBODY DRUG-CONJUGATES CD44, PABPC1, CD47 ELANE 3843/4885HPGD 4819/4885NPC1 3498/4885

“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.