SCHEMBL3405783

SCHEMBL3405783

COc1ccc(OC)c(-c2nc(C)c(C(=O)N3CCC(N(C)C)CC3)s2)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 7/20 0.48
L3MBTL3 Q96JM7 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CNR1 P21554 1/20 0.41
LRRK2 Q5S007 2/20 0.41
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
REV1 Q9UBZ9 1/20 0.40
PARP1 P09874 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL3402962 0.90 HTR2C (0.46) HTR2CMEN1KMT2AKDM4EALDH1A1
SCHEMBL3405651 0.89 HTR2C (0.45) HTR2CL3MBTL3CNR1LRRK2THRA
SCHEMBL3401389 0.86 HTR2C (0.42) HTR2CMEN1KMT2AKDM4EALDH1A1
SCHEMBL3405147 0.85 MEN1 (0.49) HTR2CL3MBTL3MEN1KMT2AALDH1A1
SCHEMBL3401211 0.85 MEN1 (0.49) HTR2CL3MBTL3MEN1KMT2AALDH1A1
SCHEMBL3402627 0.83 RAB9A (0.50) HTR2CKMT2AALDH1A1HPGD
SCHEMBL3405089 0.82 HTR2C (0.46) HTR2CMEN1KMT2AALDH1A1CNR1
SCHEMBL3399938 0.81 HTR2C (0.44) HTR2CTHRATHRB
SCHEMBL3405668 0.81 HTR2C (0.44) HTR2CALDH1A1CNR1THRBPARP1
SCHEMBL3402561 0.80 HTR2C (0.55) HTR2CL3MBTL3KMT2AALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100297035-A1 Thiazole Amides, Imidazole Amides and Related Analogues LIGAND PHARMACEUTICALS, INC. (US) 2010-11-25 US disclosed
US-7728009-B1 Thiazole amides, imidazole amides and related analogues NEUROGEN CORPORATION (US) 2010-06-01 US disclosed
US-7728009-B1 Thiazole amides, imidazole amides and related analogues NEUROGEN CORPORATION (US) 2010-06-01 US disclosed
US-7728009-B1 Thiazole amides, imidazole amides and related analogues NEUROGEN CORPORATION (US) 2010-06-01 US disclosed
WO-2006089076-A9 THIAZOLE AMIDES, IMIDAZOLE AMIDES AND RELATED ANALOGUES NEUROGEN CORP (US) 2007-04-26 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-20100297035-A1 Thiazole Amides, Imidazole Amides and Related Analogues HRH3, HRH4, HRH2 HTR2C 416/4885L3MBTL3 3567/4885MEN1 1347/4885

“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.