SCHEMBL2007035

SCHEMBL2007035

COc1ccccc1NC(=O)CC(=O)Nc1ccccc1OC

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.76
KMT2A Q03164 2/20 0.76
ALDH1A1 P00352 4/20 0.71
POLB P06746 2/20 0.71
MAPT P10636 2/20 0.67
HSD17B10 Q99714 1/20 0.67
LMNA P02545 1/20 0.67
USP2 O75604 1/20 0.67
TSHR P16473 1/20 0.67
HTT P42858 1/20 0.65
HDAC3 O15379 1/20 0.65
HDAC4 P56524 1/20 0.65
HDAC1 Q13547 1/20 0.65
HDAC7 Q8WUI4 1/20 0.65
HDAC2 Q92769 1/20 0.65
HDAC10 Q969S8 1/20 0.65
HDAC11 Q96DB2 1/20 0.65
HDAC8 Q9BY41 1/20 0.65
HDAC6 Q9UBN7 1/20 0.65
HDAC9 Q9UKV0 1/20 0.65

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
SCHEMBL14817489 0.93 KMT2A (0.68) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL1753688 0.92 HDAC3 (0.78) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL19026947 0.92 ALDH1A1 (0.67) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL54737 0.91 KMT2A (0.69) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL29389614 0.91 KMT2A (0.74) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL31590799 0.91 KMT2A (0.69) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL306869 0.91 KMT2A (0.74) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL2605742 0.90 MEN1 (0.64) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL9311962 0.90 MEN1 (0.64) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL9312795 0.90 TSHR (0.74) MEN1KMT2AALDH1A1POLBMAPT

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-7964625-B2 Antibiotics comprising bis(1-aryl-5-tetrazoly1)methane derivatives NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 2011-06-21 US disclosed
EP-1937257-B1 NOVEL ANTIBIOTICS COMPRISING BIS(1-ARYL-5-TETRAZ0LYL)METHANE DERIVATIVES TNO (NL) 2010-12-08 EP disclosed
US-20100130509-A1 NOVEL ANTIBIOTICS NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWE- TENSCHAPPELIJK ONDERZOEK TNO (NL) 2010-05-27 US disclosed
US-20080280964-A1 Novel Antibiotics Comprising Bis(1-Aryl-5-Tetrazolyl)Methane Derivatives NEDERLANDSE ORGANISATIE VOOR TOEGEPAST- NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 2008-11-13 US disclosed
EP-1978021-A1 Novel antibiotics Nederlandse Organisatie voor toegepast- natuurwetenschappelijk onderzoek TNO (NL) 2008-10-08 EP disclosed
US-5338642-A Diazo type recording material comprising two couplers wherein the novel coupler used is a bis-malonamide FUJI PHOTO FILM CO., LTD. (JP) 1994-08-16 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-20100130509-A1 NOVEL ANTIBIOTICS TMEM165, LAS1L, RPS2 MEN1 623/4885KMT2A 3035/4885ALDH1A1 4431/4885
US-20080280964-A1 Novel Antibiotics Comprising Bis(1-Aryl-5-Tetrazolyl)Methane Derivatives LAS1L, AAAS, RPS5 MEN1 1009/4885KMT2A 2575/4885ALDH1A1 3743/4885

“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.