SCHEMBL849169

SCHEMBL849169

O=C(O)c1cccc(-c2cccc(-c3ccccc3)c2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 1.00
DHODH Q02127 1/20 0.67
RXRA P19793 2/20 0.66
RXRB P28702 2/20 0.66
HDAC8 Q9BY41 1/20 0.62
LMNA P02545 1/20 0.61
GAA P10253 1/20 0.61
EGFR P00533 1/20 0.57
DAO P14920 1/20 0.56
TSHR P16473 1/20 0.56
NAPRT Q6XQN6 1/20 0.56
ERCC5 P28715 1/20 0.56
FEN1 P39748 1/20 0.56
KEAP1 Q14145 1/20 0.56
ERN1 O75460 1/20 0.56
EPHX2 P34913 1/20 0.56
NR1H4 Q96RI1 1/20 0.56
NR4A2 P43354 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
SCHEMBL30436085 0.98 KMO (0.95) KMODHODHRXRARXRBHDAC8
SCHEMBL250880 0.98 KMO (0.95) KMODHODHRXRARXRBHDAC8
SCHEMBL31752544 0.98 KMO (0.95) KMODHODHRXRARXRBHDAC8
Biphenyl SCHEMBL9652651 0.95 KMO (0.91) KMODHODHRXRARXRBHDAC8
SCHEMBL28708895 0.95 KMO (0.91) KMODHODHRXRARXRBHDAC8
SCHEMBL28702560 0.95 KMO (0.91) KMODHODHRXRARXRBHDAC8
SCHEMBL28690696 0.95 KMO (0.91) KMODHODHRXRARXRBHDAC8
SCHEMBL3220396 0.95 KMO (0.91) KMODHODHRXRARXRBHDAC8
Hydrochloric Acid SCHEMBL30713416 0.95 KMO (0.91) KMODHODHRXRARXRBHDAC8
SCHEMBL29152908 0.95 KMO (0.91) KMODHODHRXRARXRBLMNA

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-9487517-B2 Spiroimidazolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-11-08 US disclosed
US-9487517-B2 Spiroimidazolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-11-08 US disclosed
US-9487517-B2 Spiroimidazolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-11-08 US disclosed
US-20160016956-A1 SPIROIMIDAZOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-01-21 US disclosed
US-9169254-B2 Spiroimidazolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-10-27 US disclosed
US-9169254-B2 Spiroimidazolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-10-27 US disclosed
US-9169254-B2 Spiroimidazolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-10-27 US disclosed
US-20120270838-A1 SPIROIMIDAZOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2012-10-25 US disclosed
US-20120270838-A1 SPIROIMIDAZOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2012-10-25 US disclosed
US-20120270838-A1 SPIROIMIDAZOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2012-10-25 US disclosed
EP-2433940-A1 SPIROIMIDAZOLONE DERIVATIVE Chugai Seiyaku Kabushiki Kaisha (JP) 2012-03-28 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 (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-20120270838-A1 SPIROIMIDAZOLONE DERIVATIVE WNK3, REN, SGK3 KMO 4049/4885DHODH 3485/4885RXRA 2610/4885
US-20160016956-A1 SPIROIMIDAZOLONE DERIVATIVE WNK3, REN, SGK3 KMO 4049/4885DHODH 3485/4885RXRA 2610/4885

“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.