SCHEMBL6805901

SCHEMBL6805901

CNC(C(=O)O)C(C)(C)c1cccc(Br)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA5A P35218 1/20 0.36
CA9 Q16790 1/20 0.36

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
SCHEMBL6805903 1.00 SMN1; SMN2 (0.41) SMN1; SMN2MEN1KMT2AHDAC3HDAC4
SCHEMBL22111278 0.87 SMN1; SMN2 (0.40) SMN1; SMN2MEN1KMT2AHDAC3HDAC4
SCHEMBL6670756 0.84 KIF11 (0.46) SMN1; SMN2MEN1KMT2AHDAC8HDAC6
SCHEMBL6670753 0.84 KIF11 (0.46) SMN1; SMN2MEN1KMT2AHDAC8HDAC6
SCHEMBL6805400 0.83 KIF11 (0.42) ALDH1A1CA1CA2CA9LMNA
SCHEMBL6805401 0.83 KIF11 (0.42) ALDH1A1CA1CA2CA9LMNA
SCHEMBL88835 0.82 HDAC3 (0.44) KMT2AHDAC3HDAC4HDAC1HDAC7
SCHEMBL5981504 0.82 HDAC3 (0.44) KMT2AHDAC3HDAC4HDAC1HDAC7
SCHEMBL6805659 0.82 SMN1; SMN2 (0.47) SMN1; SMN2MEN1KMT2AALDH1A1RAB9A
SCHEMBL6806879 0.82 KCNN4 (0.45) HDAC3HDAC4HDAC1HDAC7HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11744876-B2 Immunomodulator antibody drug conjugates and uses thereof SUTRO BIOPHARMA, INC. (US) 2023-09-05 US disclosed
US-20160257709-A1 HEMIASTERLIN DERIVATIVES FOR CONJUGATION AND THERAPY SUTRO BIOPHARMA, INC. 2016-09-08 US disclosed
US-20160257709-A1 HEMIASTERLIN DERIVATIVES FOR CONJUGATION AND THERAPY SUTRO BIOPHARMA, INC. 2016-09-08 US disclosed
WO-2016123582-A1 HEMIASTERLIN DERIVATIVES FOR CONJUGATION AND THERAPY SUTRO BIOPHARMA, INC. (US) 2016-08-04 WO disclosed
US-20040121965-A1 Method of treating resistant tumors WYETH HOLDINGS CORPORATION (US) 2004-06-24 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 (3 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-20160257709-A1 HEMIASTERLIN DERIVATIVES FOR CONJUGATION AND THERAPY CYP17A1, HSD17B7, SHBG SMN1; SMN2 2005/4885MEN1 676/4885KMT2A 2712/4885
US-11744876-B2 Immunomodulator antibody drug conjugates and uses thereof FCGR1A, FCGR2A, FCGRT SMN1; SMN2 3797/4885MEN1 4427/4885KMT2A 2495/4885
US-20040121965-A1 Method of treating resistant tumors SLC11A2, VHL, REN SMN1; SMN2 1481/4885MEN1 40/4885KMT2A 1114/4885

“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.