SCHEMBL683810

SCHEMBL683810

COc1cc(Br)cc(/C=N/NC(=O)c2ccccc2)c1O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.65
SMN1; SMN2 Q16637 4/20 0.65
MAPK1 P28482 2/20 0.65
KMT2A Q03164 8/20 0.63
MEN1 O00255 7/20 0.63
KDM4E B2RXH2 7/20 0.63
NPC1 O15118 4/20 0.63
LMNA P02545 4/20 0.63
HTT P42858 3/20 0.63
KLF5 Q13887 2/20 0.60
L3MBTL1 Q9Y468 2/20 0.60
POLB P06746 2/20 0.60
SIRT1 Q96EB6 2/20 0.60
ASF1A Q9Y294 2/20 0.60
GAA P10253 1/20 0.59
MITF O75030 1/20 0.57
RAB9A P51151 1/20 0.57
PKM P14618 1/20 0.56
SAE1 Q9UBE0 1/20 0.56
UBA2 Q9UBT2 1/20 0.56

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
SCHEMBL21192738 1.00 MAPT (0.65) MAPTSMN1; SMN2MAPK1KMT2AMEN1
SCHEMBL21145646 0.91 MAPT (0.61) MAPTSMN1; SMN2MAPK1KMT2AMEN1
SCHEMBL684559 0.91 MAPT (0.61) MAPTSMN1; SMN2MAPK1KMT2AMEN1
SCHEMBL684649 0.89 SIRT1 (0.67) MAPTSMN1; SMN2MAPK1KMT2AMEN1
SCHEMBL12443277 0.88 KMT2A (0.73) MAPTSMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL684953 0.88 SIRT1 (0.64) MAPTSMN1; SMN2MAPK1KMT2AMEN1
SCHEMBL684648 0.88 KDM1A (0.58) MAPTSMN1; SMN2MAPK1KMT2AMEN1
SCHEMBL21192742 0.87 MEN1 (0.78) MAPTSMN1; SMN2MAPK1KMT2AMEN1
SCHEMBL684562 0.86 MAPT (0.57) MAPTSMN1; SMN2MAPK1KMT2AMEN1
SCHEMBL16181024 0.86 ERN1 (0.49) MAPTSMN1; SMN2MAPK1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170281649-A1 COMPOUNDS AND THERAPEUTIC USES UNITY BIOTECHNOLOGY, INC. 2017-10-05 US disclosed
US-9029403-B2 Treatment of ovarian cancer with benzylidenebenzohydrazides MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2015-05-12 US disclosed
US-20140315959-A1 TREATMENT OF OVARIAN CANCER WITH BENZYLIDENEBENZOHYDRAZIDES MEMORIAL SLOAN-KETTERING CANCER CENTER 2014-10-23 US disclosed
US-8865901-B2 Gain-of-function Bcl-2 inhibitors FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2014-10-21 US disclosed
US-8865901-B2 Gain-of-function Bcl-2 inhibitors FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2014-10-21 US disclosed
WO-2013071001-A1 TREATMENT OF OVARIAN CANCER WITH BENZYLIDENEBENZOHYDRAZIDES MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2013-05-16 WO disclosed
US-20120252839-A1 GAIN-OF-FUNCTION BCL-2 INHIBITORS FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2012-10-04 US disclosed
US-20120252839-A1 GAIN-OF-FUNCTION BCL-2 INHIBITORS FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2012-10-04 US disclosed
US-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 US disclosed
US-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 US disclosed
WO-2011041737-A2 GAIN-OF-FUNCTION BCL-2 INHIBITORS FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2011-04-07 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 (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-20170281649-A1 COMPOUNDS AND THERAPEUTIC USES TP53, NQO1, SHMT2 MAPT 1762/4885SMN1; SMN2 595/4885MAPK1 2835/4885
US-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, SOD3 MAPT 1491/4885SMN1; SMN2 4107/4885MAPK1 3282/4885
US-20120252839-A1 GAIN-OF-FUNCTION BCL-2 INHIBITORS BCL2, BCL2L1, BCL2L2 MAPT 3794/4885SMN1; SMN2 567/4885MAPK1 3645/4885
US-20140315959-A1 TREATMENT OF OVARIAN CANCER WITH BENZYLIDENEBENZOHYDRAZIDES BRDT, BAX, BCL2 MAPT 4837/4885SMN1; SMN2 4301/4885MAPK1 3307/4885

“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.