SCHEMBL16638438

SCHEMBL16638438

OC(Cn1c2c(c3cc(Cl)ccc31)CCCC2)c1cccnc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
ALDH1A1 P00352 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
HPGD P15428 1/20 0.42
ACLY P53396 1/20 0.42
KDM4E B2RXH2 4/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MAPK1 P28482 2/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
BCHE P06276 3/20 0.41
BACE1 P56817 1/20 0.41
RAD52 P43351 1/20 0.41
NLRP1 Q9C000 1/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
GAA P10253 1/20 0.41
NTSR1 P30989 1/20 0.41

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
SCHEMBL16638423 0.88 KMT2A (0.58) LMNAKMT2AMEN1ALDH1A1NPSR1
SCHEMBL3231330 0.88 HRH1 (0.47) LMNABCHERAD52NLRP1
SCHEMBL16638418 0.87 KMT2A (0.47) LMNAKMT2AMEN1ALDH1A1NPSR1
SCHEMBL12479844 0.86 CYP3A4 (0.42) RAD52NLRP1MAPT
SCHEMBL2186574 0.85 HRH1 (0.55) BCHE
SCHEMBL1444926 0.85 HRH1 (0.46) BCHERAD52NLRP1
SCHEMBL13834248 0.84 HRH1 (0.43) BCHERAD52NLRP1
SCHEMBL16638442 0.83 GRIN2D (0.47) KMT2AMEN1BCHE
SCHEMBL12480412 0.81 HDAC1 (0.43) BCHERAD52NLRP1
SCHEMBL3235205 0.78 HRH1 (0.58) LMNAKMT2AMEN1KDM4EL3MBTL1

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-9550782-B2 Compounds and methods for treating diabetes MEDIVATION TECHNOLOGIES, INC. (US) 2017-01-24 US disclosed
US-20150266884-A1 COMPOUNDS AND METHODS FOR TREATMENT OF HYPERTENSION MEDIVATION TECHNOLOGIES, INC. 2015-09-24 US disclosed
US-9006263-B2 Compounds and methods for treatment of hypertension MEDIVATION TECHNOLOGIES, INC. (US) 2015-04-14 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 (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-20150266884-A1 COMPOUNDS AND METHODS FOR TREATMENT OF HYPERTENSION ADRB2, ADRA2B, ADRB1 LMNA 2784/4885KMT2A 2261/4885MEN1 1590/4885

“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.