SCHEMBL5459615

SCHEMBL5459615

Cc1ccc(Cn2cnc3c(Cl)nc(Cl)nc32)cc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 8/20 0.60
HDAC1 Q13547 8/20 0.60
HDAC4 P56524 5/20 0.60
HDAC2 Q92769 5/20 0.60
HDAC3 O15379 4/20 0.60
HDAC7 Q8WUI4 4/20 0.60
HDAC10 Q969S8 4/20 0.60
HDAC11 Q96DB2 4/20 0.60
HDAC8 Q9BY41 4/20 0.60
HDAC9 Q9UKV0 4/20 0.60
HDAC5 Q9UQL6 4/20 0.60
YTHDC1 Q96MU7 8/20 0.55
P2RX7 Q99572 1/20 0.48
CCNA2 P20248 1/20 0.48
CDK2 P24941 1/20 0.48
HSP90AA1 P07900 1/20 0.47
HSP90AB1 P08238 1/20 0.47
CTSL P07711 1/20 0.46

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
SCHEMBL5465713 0.88 P2RX7 (0.56) HDAC6HDAC1HDAC4HDAC2HDAC3
SCHEMBL13596788 0.85 HDAC6 (0.57) HDAC6HDAC1HDAC4HDAC2HDAC3
SCHEMBL5461215 0.85 HDAC6 (0.60) HDAC6HDAC1HDAC4HDAC2HDAC3
SCHEMBL183057 0.85 YTHDC1 (0.68) HDAC1HDAC2HDAC8YTHDC1P2RX7
SCHEMBL30898278 0.85 YTHDC1 (0.68) HDAC1HDAC2HDAC8YTHDC1P2RX7
SCHEMBL3821565 0.85 YTHDC1 (0.57) HDAC6HDAC1HDAC4HDAC2HDAC3
SCHEMBL5471560 0.83 YTHDC1 (0.55) HDAC6HDAC1HDAC4HDAC2HDAC3
SCHEMBL5787827 0.82 ADORA2A (0.53) HDAC6HDAC1HDAC4HDAC2HDAC3
SCHEMBL5460319 0.82 YTHDC1 (0.63) HDAC6HDAC1HDAC4HDAC2HDAC3
SCHEMBL15921464 0.82 ADORA2A (0.52) HDAC6HDAC1HDAC4HDAC2HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2903987-B1 PHOSPHOLIPID DRUG ANALOGS UROGEN PHARMA LTD (IL) 2017-09-20 EP disclosed
US-20070203159-A1 Purine compounds UNIVERSITETET I OLSO (NO) 2007-08-30 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 (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-20070203159-A1 Purine compounds PNP, UMPS, TYMP HDAC6 4066/4885HDAC1 4234/4885HDAC4 3360/4885

“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.