SCHEMBL19341801

SCHEMBL19341801

Cc1cccc(Oc2cccc(Oc3cccc(N4C(=O)c5ccc([C@@](C)(c6ccc7c(c6)C(=O)N(C)C7=O)C(F)(F)F)cc5C4=O)c3)c2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.43
MAPK1 P28482 2/20 0.40
KMT2A Q03164 6/20 0.39
MEN1 O00255 5/20 0.39
ALDH1A1 P00352 5/20 0.39
HPGD P15428 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
LPAR1 Q92633 1/20 0.38
LPAR5 Q9H1C0 1/20 0.38
LPAR3 Q9UBY5 1/20 0.38
HSD17B10 Q99714 1/20 0.38
KDM4E B2RXH2 1/20 0.37
HSP90AA1 P07900 1/20 0.37
GAA P10253 1/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TLR9 Q9NR96 1/20 0.37
USP2 O75604 1/20 0.37

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
SCHEMBL25721528 1.00 BRD4 (0.43) BRD4MAPK1KMT2AMEN1ALDH1A1
SCHEMBL12432392 0.91 BRD4 (0.44) BRD4MAPK1KMT2AMEN1ALDH1A1
SCHEMBL17714976 0.90 MAPK1 (0.48) MAPK1KMT2AMEN1ALDH1A1HPGD
SCHEMBL20286680 0.88 MAPK1 (0.44) MAPK1KMT2AMEN1ALDH1A1HSD17B10
SCHEMBL14310857 0.87 BRD4 (0.44) BRD4MAPK1KMT2AMEN1ALDH1A1
SCHEMBL25627495 0.85 BRD4 (0.50) BRD4MAPK1KMT2AMEN1ALDH1A1
SCHEMBL12574001 0.85 BRD4 (0.59) BRD4MAPK1KMT2AMEN1ALDH1A1
SCHEMBL16234042 0.84 MEN1 (0.46) BRD4KMT2AMEN1ALDH1A1HPGD
SCHEMBL15744784 0.84 BRD4 (0.48) BRD4MAPK1KMT2AMEN1ALDH1A1
SCHEMBL14010049 0.83 BRD4 (0.56) BRD4MAPK1KMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180194898-A1 HYGROMORPHIC POLYMERS AND COPOLYMERS HAVING HUMIDITY-DRIVEN MOTILITY GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2018-07-12 US disclosed
US-9932445-B2 Hygromorphic polymers and copolymers having humidity-driven motility THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2018-04-03 US disclosed
US-20170260334-A1 HYGROMORPHIC POLYMERS AND COPOLYMERS HAVING HUMIDITY-DRIVEN MOTILITY GOVERNMENT OF THE UNITED STATES AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2017-09-14 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 (2 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-20180194898-A1 HYGROMORPHIC POLYMERS AND COPOLYMERS HAVING HUMIDITY-DRIVEN MOTILITY DNAH12, PARG, PARN BRD4 2165/4885MAPK1 2432/4885KMT2A 1721/4885
US-20170260334-A1 HYGROMORPHIC POLYMERS AND COPOLYMERS HAVING HUMIDITY-DRIVEN MOTILITY DNAH12, PARG, PARN BRD4 2165/4885MAPK1 2432/4885KMT2A 1721/4885

“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.