SCHEMBL627571

SCHEMBL627571

O=C(O)CC1(c2ccc(F)cc2)CCC1

nearest known ligand 0.90

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 14/20 0.90
SLC6A3 Q01959 3/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
SLC6A4 P31645 2/20 0.47
SLC6A2 P23975 1/20 0.47
CACNA1G O43497 2/20 0.45

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
SCHEMBL4245329 0.96 HSD11B1 (0.97) HSD11B1SLC6A3MEN1KMT2ASLC6A4
SCHEMBL16232160 0.93 HSD11B1 (0.83) HSD11B1SLC6A3MEN1KMT2A
SCHEMBL18111428 0.85 HSD11B1 (0.71) HSD11B1MEN1KMT2ACACNA1G
SCHEMBL17761217 0.84 HSD11B1 (0.66) HSD11B1SLC6A3MEN1KMT2ASLC6A4
SCHEMBL625584 0.83 HSD11B1 (0.64) HSD11B1SLC6A3MEN1KMT2ASLC6A4
SCHEMBL624643 0.82 HSD11B1 (0.63) HSD11B1SLC6A3SLC6A4SLC6A2
SCHEMBL14525408 0.82 HSD11B1 (0.63) HSD11B1KMT2A
SCHEMBL625060 0.81 HSD11B1 (0.62) HSD11B1SLC6A3SLC6A4SLC6A2
SCHEMBL17761311 0.81 HSD11B1 (0.71) HSD11B1SLC6A3SLC6A4SLC6A2CACNA1G
SCHEMBL627858 0.80 HSD11B1 (0.60) HSD11B1SLC6A3MEN1KMT2ASLC6A4

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-9156788-B2 TRPV3 modulators ABBVIE INC. (US) 2015-10-13 US disclosed
EP-2603490-A1 NOVEL TRPV3 MODULATORS AbbVie Inc. (US) 2013-06-19 EP disclosed
US-20130150409-A1 NOVEL TRPV3 MODULATORS ABBVIE INC. (US) 2013-06-13 US disclosed
CN-103140476-A Novel trpv3 modulators ABBOTT LAB 2013-06-05 CN disclosed
WO-2012019315-A1 NOVEL TRPV3 MODULATORS ABBOTT LABORATORIES (US) 2012-02-16 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-20130150409-A1 NOVEL TRPV3 MODULATORS TRPV3, TRPV4, TRPV5 HSD11B1 2616/4885SLC6A3 717/4885MEN1 4188/4885

“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.