SCHEMBL7706286

SCHEMBL7706286

O=C(O)/C=C/c1ccc2c(c1)CCN2Cc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.50
HDAC1 Q13547 3/20 0.47
KCNH2 Q12809 1/20 0.47
HDAC6 Q9UBN7 3/20 0.47
HDAC4 P56524 2/20 0.47
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
RAB9A P51151 2/20 0.46
ACHE P22303 2/20 0.44
ALOX5 P09917 2/20 0.44
EPHX2 P34913 2/20 0.44
HDAC3 O15379 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
POLB P06746 2/20 0.43

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
SCHEMBL7714753 0.89 HDAC1 (0.45) ESR1HDAC1KCNH2HDAC6HDAC4
SCHEMBL17358766 0.88 HDAC1 (0.64) HDAC1KCNH2HDAC6HDAC4HDAC3
SCHEMBL7706212 0.87 HDAC1 (0.43) ESR1HDAC1KCNH2HDAC6HDAC4
SCHEMBL14156161 0.84 KMT2A (0.46) ESR1HDAC1HDAC6HDAC4KMT2A
SCHEMBL3218987 0.83 HPGD (0.48) KMT2AMEN1ACHEALOX5EPHX2
SCHEMBL697874 0.78 ALOX5 (0.56) HDAC1HDAC6HDAC4ACHEALOX5
SCHEMBL7706214 0.77 HDAC6 (0.44) HDAC1HDAC6HDAC4ALOX5EPHX2
SCHEMBL17358767 0.77 BRD4 (0.45) HDAC6KMT2AMEN1ALOX5POLB
SCHEMBL2511469 0.77 MEN1 (0.64) KMT2AMEN1RAB9APOLBSMN1; SMN2
SCHEMBL2511471 0.77 MEN1 (0.64) KMT2AMEN1RAB9APOLBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9598364-B2 Indolyl or indolinyl hydroxamate compounds TAIPEI MEDICAL UNIVERSITY (TW) 2017-03-21 US disclosed
US-20150368195-A1 INDOLINE COMPOUNDS FOR TREATMENT AND/OR PREVENTION OF INFLAMMATION DISEASES TAIPEI MEDICAL UNIVERSITY (TW) 2015-12-24 US disclosed
US-20140364477-A1 INDOLYL OR INDOLINYL HYDROXAMATE COMPOUNDS TAIPEI MEDICAL UNIVERSITY (TW) 2014-12-11 US disclosed
US-8846748-B2 Indolyl or indolinyl hydroxamate compounds TAIPEI MEDICAL UNIVERSITY (TW) 2014-09-30 US disclosed
US-20110245315-A1 INDOLYL OR INDOLINYL HYDROXAMATE COMPOUNDS TAIPEI MEDICAL UNIVERSITY (TW) 2011-10-06 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 (3 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-20150368195-A1 INDOLINE COMPOUNDS FOR TREATMENT AND/OR PREVENTION OF INFLAMMATION DISEASES IDO1, IDO2, INMT ESR1 2474/4885HDAC1 563/4885KCNH2 4704/4885
US-20110245315-A1 INDOLYL OR INDOLINYL HYDROXAMATE COMPOUNDS IDH3A, IDH2, IDH3B ESR1 1019/4885HDAC1 8/4885KCNH2 1548/4885
US-20140364477-A1 INDOLYL OR INDOLINYL HYDROXAMATE COMPOUNDS IDH3A, IDH2, IDH3B ESR1 1019/4885HDAC1 8/4885KCNH2 1548/4885

“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.