SCHEMBL2215260

SCHEMBL2215260

COC(=O)[C@H](C)OCc1ccc(Br)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
KDM4E B2RXH2 4/20 0.44
KMT2A Q03164 4/20 0.44
MAPT P10636 3/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 3/20 0.44
HDAC1 Q13547 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43
MAOB P27338 1/20 0.43
GLA P06280 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SMPD1 P17405 1/20 0.42
POLB P06746 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41

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
SCHEMBL12437265 1.00 TDP1 (0.46) TDP1KDM4EKMT2AMAPTMEN1
SCHEMBL15409086 0.83 HTT (0.53) TDP1MAPTALDH1A1POLB
SCHEMBL4008583 0.83 HTT (0.53) TDP1MAPTALDH1A1POLB
SCHEMBL1967755 0.83 RXRA (0.46) KDM4EKMT2AMAPTALDH1A1LMNA
SCHEMBL1967754 0.83 RXRA (0.46) KDM4EKMT2AMAPTALDH1A1LMNA
SCHEMBL2384186 0.83 ALDH1A1 (0.52) TDP1KMT2AMAPTMEN1ALDH1A1
SCHEMBL584760 0.83 ALDH1A1 (0.52) TDP1KMT2AMAPTMEN1ALDH1A1
SCHEMBL584761 0.83 ALDH1A1 (0.52) TDP1KMT2AMAPTMEN1ALDH1A1
SCHEMBL28765232 0.82 CYP3A4 (0.42) KMT2AMEN1ALDH1A1HDAC1HDAC6
SCHEMBL4699315 0.81 LMNA (0.43) TDP1KDM4EKMT2AMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9340493-B2 Hydroxamic acid derivatives useful as antibacterial agents PFIZER INC. (US) 2016-05-17 US disclosed
US-20140206651-A1 Hydroxamic Acid Derivatives Useful As Antibacterial Agents PFIZER INC. (US) 2014-07-24 US disclosed
US-8722686-B2 Hydroxamic acid derivatives useful as antibacterial agents PFIZER INC. (US) 2014-05-13 US disclosed
US-8722686-B2 Hydroxamic acid derivatives useful as antibacterial agents PFIZER INC. (US) 2014-05-13 US disclosed
US-20110178042-A1 Hydroxamic Acid Derivatives Useful as Antibacterial Agents PFIZER INC. (US) 2011-07-21 US disclosed
US-20110178042-A1 Hydroxamic Acid Derivatives Useful as Antibacterial Agents PFIZER INC. (US) 2011-07-21 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-20140206651-A1 Hydroxamic Acid Derivatives Useful As Antibacterial Agents HCAR1, H1-0, HDAC1 TDP1 4146/4885KDM4E 947/4885KMT2A 708/4885
US-20110178042-A1 Hydroxamic Acid Derivatives Useful as Antibacterial Agents HCAR1, HDAC1, H1-0 TDP1 3819/4885KDM4E 1040/4885KMT2A 681/4885

“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.