SCHEMBL4521181

SCHEMBL4521181

O=C1C(Cc2ccc(OCCCO)cc2Cl)CCN1C1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.46
HPGD P15428 3/20 0.39
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
POLB P06746 1/20 0.36
HCRTR1 O43613 2/20 0.36
TP53 P04637 2/20 0.36
FFAR1 O14842 3/20 0.36
P2RX7 Q99572 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.34
HCRTR2 O43614 1/20 0.34

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
SCHEMBL4525800 0.95 HSD11B1 (0.47) HSD11B1HPGDKDM4EALDH1A1SMN1; SMN2
SCHEMBL13674511 0.89 HSD11B1 (0.47) HSD11B1HPGDKDM4EPOLBHCRTR1
SCHEMBL13675458 0.88 HSD11B1 (0.45) HSD11B1HPGDKDM4ETP53LMNA
Hydrochloric Acid SCHEMBL4514348 0.88 HSD11B1 (0.46) HSD11B1HPGDKDM4EPOLBHCRTR1
SCHEMBL4514386 0.88 HSD11B1 (0.46) HSD11B1HPGDKDM4EHCRTR1TP53
SCHEMBL4520465 0.88 HPGD (0.48) HSD11B1HPGDKDM4EPOLBHCRTR1
SCHEMBL4516252 0.88 HSD11B1 (0.55) HSD11B1HPGDKDM4EPOLBHCRTR1
SCHEMBL13675721 0.87 HSD11B1 (0.44) HSD11B1HPGDKDM4EALDH1A1TP53
SCHEMBL4514686 0.87 KDM4E (0.50) HSD11B1KDM4EALDH1A1SMN1; SMN2POLB
SCHEMBL4519067 0.87 HSD11B1 (0.50) HSD11B1FFAR1

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-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
EP-1864971-A1 PROPHYLACTIC/THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2007-12-12 EP disclosed
EP-1864971-A1 PROPHYLACTIC/THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2007-12-12 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 (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-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes HSD11B1, HSD17B1, HSD11B2 HSD11B1 1/4885HPGD 63/4885KDM4E 2703/4885

“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.