SCHEMBL4828392

SCHEMBL4828392

CC(=CC(=O)O)c1cc2ccccc2o1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.59
NPC1 O15118 9/20 0.57
RAB9A P51151 9/20 0.57
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
MAPK1 P28482 2/20 0.57
TSHR P16473 1/20 0.57
ALDH1A1 P00352 6/20 0.55
HPGD P15428 4/20 0.55
SMN1; SMN2 Q16637 5/20 0.53
TP53 P04637 3/20 0.53
PKM P14618 2/20 0.53
NFKB1 P19838 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
MAPT P10636 4/20 0.51
LMNA P02545 1/20 0.50
THRB P10828 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CASP3 P42574 2/20 0.49

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
SCHEMBL4828388 1.00 FLT3 (0.59) FLT3NPC1RAB9AMEN1KMT2A
SCHEMBL6958107 1.00 FLT3 (0.59) FLT3NPC1RAB9AMEN1KMT2A
Hydrochloric Acid SCHEMBL6783777 0.98 FLT3 (0.57) FLT3NPC1RAB9AMEN1KMT2A
SCHEMBL6783774 0.86 FLT3 (0.57) FLT3NPC1RAB9AMEN1KMT2A
SCHEMBL4828383 0.80 MAPT (0.52) FLT3NPC1RAB9AMEN1KMT2A
SCHEMBL4828386 0.80 MAPT (0.52) FLT3NPC1RAB9AMEN1KMT2A
SCHEMBL14404773 0.80 FLT3 (0.56) FLT3NPC1RAB9AMEN1KMT2A
SCHEMBL657915 0.79 NPC1 (0.64) FLT3NPC1RAB9AMEN1KMT2A
SCHEMBL241548 0.79 FLT3 (0.71) FLT3NPC1RAB9AMEN1KMT2A
Hydrochloric Acid SCHEMBL6784307 0.79 MAOB (0.66) NPC1RAB9ATSHRALDH1A1HPGD

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-7368476-B2 Hydroxamates as therapeutic agents PHARMACYCLICS, INC. (US) 2008-05-06 US disclosed
WO-2005097770-A1 NOVEL HYDROXAMATES AS THERAPEUTIC AGENTS PHARMACYCLICS, INC. (US) 2005-10-20 WO disclosed
US-20050227976-A1 Novel hydroxamates as therapeutic agents AXYS PHARMACEUTICALS, INC. (US) 2005-10-13 US disclosed
EP-0974584-B1 FUSED RING COMPOUNDS, PROCESS FOR PRODUCING THE SAME AND USE THEREOF TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-01-15 EP disclosed
US-6420375-B1 ANTITUMOR TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-07-16 US disclosed
EP-0974584-A1 FUSED RING COMPOUNDS, PROCESS FOR PRODUCING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2000-01-26 EP 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 (1 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-20050227976-A1 Novel hydroxamates as therapeutic agents HDAC1, HDAC5, HDAC10 FLT3 2617/4885NPC1 2712/4885RAB9A 4306/4885

“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.