SCHEMBL19971565

SCHEMBL19971565

c1ccc2c(c1)Nc1c(ccc3nc4ccccc4cc13)O2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 11/20 0.44
DHODH Q02127 1/20 0.43
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 2/20 0.41
GLA P06280 2/20 0.41
HPGD P15428 2/20 0.41
GAA P10253 2/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
PTBP1 P26599 1/20 0.41
RAB9A P51151 1/20 0.41
RCE1 Q9Y256 1/20 0.41
MAPT P10636 3/20 0.39
ACHE P22303 1/20 0.39
IDO1 P14902 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HTR7 P34969 1/20 0.33

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
SCHEMBL325772 0.85 ALOX5 (0.45) ALOX5DHODHKMT2AALDH1A1NPC1
SCHEMBL28780034 0.85 ALOX5 (0.45) ALOX5DHODHKMT2AALDH1A1GLA
SCHEMBL9838372 0.84 ALOX5 (0.41) ALOX5DHODHKMT2ANPC1RAB9A
Phenoxazine SCHEMBL27458642 0.81 ALOX5 (0.63) ALOX5DHODHKMT2AALDH1A1GLA
SCHEMBL9840343 0.80 ALOX5 (0.40) ALOX5DHODHMAPTTDP1L3MBTL1
Phenoxazine SCHEMBL28350911 0.80 ALOX5 (0.61) ALOX5DHODHKMT2AALDH1A1GLA
SCHEMBL31191628 0.77 ALOX5 (0.55) ALOX5DHODHALDH1A1GLAHPGD
SCHEMBL121074 0.77 ALOX5 (0.55) ALOX5DHODHALDH1A1GLAHPGD
SCHEMBL30530994 0.77 ALOX5 (0.55) ALOX5DHODHALDH1A1GLAHPGD
SCHEMBL28571843 0.75 ALOX5 (0.53) ALOX5DHODHALDH1A1GLAHPGD

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-10654869-B2 Bacterial topoisomerase I inhibitors with antibacterial activity THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES (US) 2020-05-19 US disclosed
US-20190194224-A1 BACTERIAL TOPOISOMERASE I INHIBITORS WITH ANTIBACTERIAL ACTIVITY THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES 2019-06-27 US disclosed
US-10266550-B2 Bacterial topoisomerase I inhibitors with antibacterial activity THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES (US) 2019-04-23 US disclosed
US-20180079757-A1 BACTERIAL TOPOISOMERASE I INHIBITORS WITH ANTIBACTERIAL ACTIVITY THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES 2018-03-22 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-20180079757-A1 BACTERIAL TOPOISOMERASE I INHIBITORS WITH ANTIBACTERIAL ACTIVITY TOP1, TOP2A, TOP2B ALOX5 2757/4885DHODH 624/4885KMT2A 2065/4885
US-10654869-B2 Bacterial topoisomerase I inhibitors with antibacterial activity TOP1, TOP2A, TOP2B ALOX5 2757/4885DHODH 624/4885KMT2A 2065/4885
US-10266550-B2 Bacterial topoisomerase I inhibitors with antibacterial activity TOP1, TOP2A, TOP2B ALOX5 2757/4885DHODH 624/4885KMT2A 2065/4885
US-20190194224-A1 BACTERIAL TOPOISOMERASE I INHIBITORS WITH ANTIBACTERIAL ACTIVITY TOP1, TOP2A, TOP2B ALOX5 2861/4885DHODH 663/4885KMT2A 2126/4885

“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.