SCHEMBL194757

SCHEMBL194757

COc1cc(CCNC(=O)Cc2cc(OC)c(OC)c(OC)c2)ccc1-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.59
SMN1; SMN2 Q16637 3/20 0.58
KMT2A Q03164 4/20 0.56
MEN1 O00255 2/20 0.56
MCL1 Q07820 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
ALDH1A1 P00352 2/20 0.48
POLB P06746 2/20 0.48
HTT P42858 2/20 0.48
IL1RN P18510 1/20 0.48
ERAP2 Q6P179 1/20 0.48
ERAP1 Q9NZ08 1/20 0.48
MAPT P10636 1/20 0.48
MAP3K11 Q16584 1/20 0.48

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
SCHEMBL130060 0.89 SMN1; SMN2 (0.55) LMNASMN1; SMN2KMT2ATAAR1CA1
SCHEMBL147536 0.88 SMN1; SMN2 (0.64) LMNASMN1; SMN2KMT2AMEN1CA1
SCHEMBL192947 0.85 KMT2A (0.54) LMNASMN1; SMN2KMT2AMEN1MCL1
SCHEMBL128950 0.85 KMT2A (0.54) LMNASMN1; SMN2KMT2AMEN1TAAR1
SCHEMBL5094513 0.84 SMN1; SMN2 (0.75) LMNASMN1; SMN2KMT2AMEN1CA1
SCHEMBL6378383 0.82 MEN1 (0.79) LMNAKMT2AMEN1CA1CA2
SCHEMBL29389598 0.82 MEN1 (0.79) LMNAKMT2AMEN1CA1CA2
SCHEMBL28000837 0.82 KMT2A (0.64) LMNASMN1; SMN2KMT2AMEN1TAAR1
SCHEMBL13076594 0.82 LMNA (0.69) LMNASMN1; SMN2KMT2AMEN1CA1
SCHEMBL147264 0.81 SMN1; SMN2 (0.57) LMNASMN1; SMN2KMT2AMEN1CA1

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-9227966-B2 Antimicrobial agents RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2016-01-05 US disclosed
US-20140315939-A1 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2014-10-23 US disclosed
US-20120059026-A1 ANTIMICROBIAL AGENTS UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2012-03-08 US disclosed
WO-2010127307-A1 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2010-11-04 WO 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-20120059026-A1 ANTIMICROBIAL AGENTS ZYX, Q6ZSR9, ZC3HAV1L LMNA 3821/4885SMN1; SMN2 3296/4885KMT2A 2296/4885
US-20140315939-A1 ANTIMICROBIAL AGENTS ZYX, Q6ZSR9, ZC3HAV1L LMNA 3733/4885SMN1; SMN2 3143/4885KMT2A 2237/4885

“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.