SCHEMBL6400417

SCHEMBL6400417

C=CCN(C)CC=CCOc1ccc2c(c1)CCCN2S(=O)(=O)Nc1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
LSS P48449 6/20 0.39
MAPT P10636 5/20 0.39
TP53 P04637 4/20 0.39
LMNA P02545 1/20 0.36
RORC P51449 1/20 0.36
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
NLRP3 Q96P20 1/20 0.33

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
SCHEMBL6429091 1.00 MEN1 (0.43) MEN1KMT2ALSSMAPTTP53
SCHEMBL5638296 0.92 MAPT (0.47) LSSMAPTTP53LMNA
SCHEMBL6403814 0.92 NLRP3 (0.41) MEN1KMT2ALSSMAPTTP53
SCHEMBL6430242 0.92 LSS (0.49) MEN1KMT2ALSSMAPTTP53
SCHEMBL6398603 0.92 LSS (0.49) MEN1KMT2ALSSMAPTTP53
SCHEMBL6400289 0.92 MAPT (0.41) MEN1KMT2ALSSMAPTTP53
SCHEMBL5635668 0.91 HRH3 (0.41) MEN1KMT2ALSSMAPTTP53
SCHEMBL6406579 0.91 LSS (0.40) MEN1KMT2ALSSMAPTTP53
SCHEMBL6403927 0.90 MAPT (0.40) MEN1KMT2ALSSMAPTTP53
SCHEMBL6404825 0.89 MAPT (0.40) LSSMAPTTP53LMNARORC

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-20050187390-A1 Bicyclic heteroaryl derivatives GENELABS TECHNOLOGIES, INC. 2005-08-25 US disclosed
US-20050020624-A1 Dihydroindole and tetrahydroquinoline derivatives AEBI JOHANNES (CH) 2005-01-27 US disclosed
US-6844351-B1 Corticotropin releasing factor antagonists PFIZER INC. (US) 2005-01-18 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-20050020624-A1 Dihydroindole and tetrahydroquinoline derivatives CYP46A1, LSS, CYP51A1 MEN1 402/4885KMT2A 2451/4885LSS 2/4885
US-20050187390-A1 Bicyclic heteroaryl derivatives HAVCR2, MAVS, ZC3HAV1 MEN1 4832/4885KMT2A 2410/4885LSS 65/4885

“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.