SCHEMBL16827166

SCHEMBL16827166

CC(C)n1cc2cccc(C(=O)NCC3CCN(C(=O)OC(C)(C)C)CC3)c2n1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.56
PKM P14618 1/20 0.56
HTR4 Q13639 7/20 0.49
HTR3A P46098 4/20 0.49
IL1B P01584 2/20 0.46
P2RX7 Q99572 2/20 0.46
TP53 P04637 5/20 0.45
UTS2R Q9UKP6 1/20 0.44
LMNA P02545 4/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
PARP1 P09874 1/20 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
SCHEMBL16827187 0.86 HTR4 (0.43) KDM4EPKMHTR4HTR3AIL1B
SCHEMBL18171071 0.85 HTR4 (0.58) HTR4HTR3A
SCHEMBL19867073 0.84 KDM4E (0.47) KDM4EPKM
SCHEMBL16827148 0.84 HTR4 (0.60) HTR4HTR3A
SCHEMBL16827092 0.83 HTR4 (0.49) HTR4HTR3A
SCHEMBL16827070 0.83 IL1B (0.45) HTR4IL1BP2RX7PARP1
SCHEMBL16827100 0.83 HTR4 (0.51) HTR4HTR3A
SCHEMBL16827093 0.82 HDAC8 (0.46) IL1BP2RX7PARP1
SCHEMBL6980865 0.82 KDM4E (0.61) KDM4EPKMHTR4HTR3ATP53
SCHEMBL16827177 0.82 HTR4 (0.50) HTR4HTR3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9951045-B2 Indazole compounds as 5-HT4 receptor agonists SUVEN LIFE SCIENCES LIMITED (IN) 2018-04-24 US disclosed
US-9951045-B2 Indazole compounds as 5-HT4 receptor agonists SUVEN LIFE SCIENCES LIMITED (IN) 2018-04-24 US disclosed
EP-3099675-B1 INDAZOLE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LTD (IN) 2018-02-14 EP disclosed
EP-3099675-A1 INDAZOLE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS Suven Life Sciences Limited (IN) 2016-12-07 EP disclosed
US-20160311797-A1 INDAZOLE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2016-10-27 US disclosed
US-20160311797-A1 INDAZOLE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2016-10-27 US disclosed
WO-2015092804-A1 INDAZOLE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2015-06-25 WO disclosed
WO-2015092804-A1 INDAZOLE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS SUVEN LIFE SCIENCES LIMITED (IN) 2015-06-25 WO 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-20160311797-A1 INDAZOLE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS HTR4, HTR5A, HTR1A KDM4E 1816/4885PKM 2565/4885HTR4 1/4885

“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.