SCHEMBL15260867

SCHEMBL15260867

Cc1ccc(C(=O)NC(C(=O)O)C(C)(C)C)cc1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.66
SMN1; SMN2 Q16637 3/20 0.59
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
HPGD P15428 3/20 0.54
ALDH1A1 P00352 3/20 0.50
GAA P10253 1/20 0.50
LMNA P02545 4/20 0.49
TP53 P04637 1/20 0.49
HDAC1 Q13547 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
TRPA1 O75762 1/20 0.47
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
MAPT P10636 1/20 0.45
POLB P06746 1/20 0.45

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
SCHEMBL4680240 0.86 CA2 (0.65) CA2SMN1; SMN2HPGDALDH1A1LMNA
SCHEMBL7897280 0.86 CA2 (0.65) CA2SMN1; SMN2HPGDALDH1A1LMNA
SCHEMBL4680332 0.85 CA2 (0.64) CA2SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL4685570 0.85 SMN1; SMN2 (0.57) CA2SMN1; SMN2MEN1KMT2AHPGD
SCHEMBL9829496 0.84 SMN1; SMN2 (0.53) CA2SMN1; SMN2MEN1KMT2AHPGD
SCHEMBL76588 0.84 SMN1; SMN2 (0.54) CA2SMN1; SMN2MEN1KMT2AHPGD
SCHEMBL9829495 0.84 SMN1; SMN2 (0.53) CA2SMN1; SMN2MEN1KMT2AHPGD
SCHEMBL76893 0.84 SMN1; SMN2 (0.54) CA2SMN1; SMN2MEN1KMT2AHPGD
SCHEMBL21310010 0.82 CA2 (0.61) CA2SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL15049593 0.78 SMN1; SMN2 (0.61) SMN1; SMN2MEN1KMT2AHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130252984-A1 SULFUR DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN, INC. (US) 2013-09-26 US claimed
US-11046644-B2 Sulfur derivatives as chemokine receptor modulators ALLERGAN, INC. (US) 2021-06-29 US disclosed
US-20200109110-A1 SULFUR DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN INC (US) 2020-04-09 US disclosed
US-10287243-B2 Sulfur derivatives as chemokine receptor modulators ALLERGAN, INC. (US) 2019-05-14 US disclosed
US-9328067-B2 Sulfur derivatives as chemokine receptor modulators ALLERGAN, INC. (US) 2016-05-03 US disclosed
US-20160083342-A1 SULFUR DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN, INC. 2016-03-24 US disclosed
US-20130252984-A1 SULFUR DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN, INC. (US) 2013-09-26 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 (5 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-20160083342-A1 SULFUR DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS CX3CR1, CXCR2, CCR2 CA2 3847/4885SMN1; SMN2 4664/4885MEN1 4826/4885
US-20200109110-A1 SULFUR DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS CX3CR1, CXCR2, CCR2 CA2 3847/4885SMN1; SMN2 4664/4885MEN1 4826/4885
US-20130252984-A1 SULFUR DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS CX3CR1, CXCR2, CCR2 CA2 3847/4885SMN1; SMN2 4664/4885MEN1 4826/4885
US-10287243-B2 Sulfur derivatives as chemokine receptor modulators CX3CR1, CXCR2, CCR2 CA2 3847/4885SMN1; SMN2 4664/4885MEN1 4826/4885
US-11046644-B2 Sulfur derivatives as chemokine receptor modulators CX3CR1, CXCR2, CCR2 CA2 3847/4885SMN1; SMN2 4664/4885MEN1 4826/4885

“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.