SCHEMBL7593404

SCHEMBL7593404

Cn1c(C(=O)O)c(-c2ccccc2)c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
LMNA P02545 2/20 0.55
KDM4E B2RXH2 4/20 0.49
TDP1 Q9NUW8 1/20 0.49
GRIA4 P48058 2/20 0.49
GRIA2 P42262 1/20 0.49
EGFR P00533 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.48
HSD17B10 Q99714 3/20 0.47
CYP2C19 P33261 1/20 0.47
MEN1 O00255 1/20 0.47
POLB P06746 1/20 0.47
PADI4 Q9UM07 1/20 0.47
ALDH1A1 P00352 2/20 0.47
NPC1 O15118 1/20 0.47
MAPT P10636 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
ATM Q13315 1/20 0.47

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
SCHEMBL16144912 0.87 LMNA (0.53) KMT2ASMN1; SMN2LMNAKDM4ETDP1
SCHEMBL6017853 0.87 SMN1; SMN2 (0.53) KMT2ASMN1; SMN2LMNAKDM4ETDP1
SCHEMBL27749841 0.85 PTGER1 (0.44) KMT2ASMN1; SMN2LMNAKDM4EEGFR
SCHEMBL7671576 0.83 KMT2A (0.49) KMT2ASMN1; SMN2LMNAKDM4ETDP1
SCHEMBL8687160 0.82 ACLY (0.62) KMT2AKDM4EGRIA4GRIA2EGFR
SCHEMBL8784770 0.81 TACR1 (0.55) KMT2ASMN1; SMN2LMNAGRIA4GRIA2
SCHEMBL7134859 0.80 KMT2A (0.44) KMT2ASMN1; SMN2LMNAKDM4ETDP1
SCHEMBL4399199 0.80 KMT2A (0.48) KMT2ASMN1; SMN2LMNAKDM4ETDP1
SCHEMBL11791604 0.79 KMT2A (0.62) KMT2ASMN1; SMN2LMNAKDM4EL3MBTL1
SCHEMBL7607181 0.79 KMT2A (0.43) KMT2ASMN1; SMN2LMNAKDM4EMEN1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11439622-B2 Inhibitors of metallo-beta-lactamases OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2022-09-13 US claimed
CN-108602795-B Inhibitors of metallo-beta-lactamases 牛津大学科技创新有限公司 2022-04-22 CN claimed
US-20200375946-A1 INHIBITORS OF METALLO-BETA-LACTAMASES OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2020-12-03 US claimed
CN-108602795-A The inhibitor of metal-beta-lactamase 牛津大学科技创新有限公司 2018-09-28 CN claimed
US-11439622-B2 Inhibitors of metallo-beta-lactamases OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2022-09-13 US disclosed
CN-108602795-B Inhibitors of metallo-beta-lactamases 牛津大学科技创新有限公司 2022-04-22 CN disclosed
US-20200375946-A1 INHIBITORS OF METALLO-BETA-LACTAMASES OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2020-12-03 US disclosed
US-20200375946-A1 INHIBITORS OF METALLO-BETA-LACTAMASES OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2020-12-03 US disclosed
CN-108602795-A The inhibitor of metal-beta-lactamase 牛津大学科技创新有限公司 2018-09-28 CN disclosed
EP-2655323-B1 INGENOL-3-ACYLATES III AND INGENOL-3-CARBAMATES LEO LABORATORIES LTD (IE) 2017-12-20 EP disclosed
US-20170217910-A1 INGENOL-3-ACYLATES III AND INGENOL-3-CARBAMATES LEO LABORATORIES LIMITED (IE) 2017-08-03 US disclosed
US-9708286-B2 Ingenol-3-acylates III and ingenol-3-carbamates LEO LABORATORIES LIMITED (IE) 2017-07-18 US disclosed
US-9102687-B2 Ingenol-3-acylates III and ingenol-3-carbamates LEO LABORATORIES LIMITED (IE) 2015-08-11 US disclosed
CN-104529827-A Ingenol-3-acylates III and ingenol-3-carbamates LEO PHARMA AS 2015-04-22 CN disclosed
US-20140303150-A1 INGENOL-3-ACYLATES III AND INGENOL-3-CARBAMATES LEO LABORATORIES LIMITED (IE) 2014-10-09 US disclosed
CN-103402977-A Ingenol-3-acylate III and Ingenol-3-carbamate LEO PHARMA AS 2013-11-20 CN disclosed
EP-2655323-A1 INGENOL-3-ACYLATES III AND INGENOL-3-CARBAMATES LEO LABORATORIES LIMITED (IE) 2013-10-30 EP disclosed
WO-2012083953-A1 INGENOL-3-ACYLATES III AND INGENOL-3-CARBAMATES LEO PHARMA A/S (DK) 2012-06-28 WO disclosed
WO-2002022576-A2 3-SUBSTITUTED INDOLE CARBOHYDRAZIDES USEFUL AS CELL PROLIFERATION AND ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 2002-03-21 WO disclosed
US-3935193-A ANTIBIOTICS TOYO JOZO KABUSHIKI KAISHA (JA) 1976-01-27 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 (4 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-20170217910-A1 INGENOL-3-ACYLATES III AND INGENOL-3-CARBAMATES RXRB, RXRA, RXRG KMT2A 3459/4885SMN1; SMN2 4677/4885LMNA 3996/4885
US-20140303150-A1 INGENOL-3-ACYLATES III AND INGENOL-3-CARBAMATES RXRB, RXRA, RXRG KMT2A 3459/4885SMN1; SMN2 4677/4885LMNA 3996/4885
US-11439622-B2 Inhibitors of metallo-beta-lactamases IDO1, MGAM, LCT KMT2A 1235/4885SMN1; SMN2 3913/4885LMNA 2052/4885
US-20200375946-A1 INHIBITORS OF METALLO-BETA-LACTAMASES IDO1, MGAM, LCT KMT2A 1235/4885SMN1; SMN2 3913/4885LMNA 2052/4885

“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.