SCHEMBL13100656

SCHEMBL13100656

COc1cccc(CCC(C(=O)O)c2ccccc2)c1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 6/20 0.49
MTNR1B P49286 6/20 0.49
TAAR1 Q96RJ0 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
ABCB1 P08183 2/20 0.48
HTR1A P08908 1/20 0.48
DRD2 P14416 1/20 0.48
CYP1A2 P05177 1/20 0.48
HDAC1 Q13547 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL6050076 0.94 MTNR1A (0.49) MTNR1AMTNR1BTAAR1L3MBTL1CYP1A2
SCHEMBL6667447 0.93 AKR1C3 (0.50) MTNR1AMTNR1BTAAR1CYP1A2HDAC1
SCHEMBL5077290 0.92 MTNR1A (0.53) MTNR1AMTNR1BHDAC1HDAC6
SCHEMBL10596068 0.90 AKR1C3 (0.49) MTNR1AMTNR1BTAAR1ABCB1HTR1A
SCHEMBL11820853 0.88 ABCB1 (0.51) MTNR1AMTNR1BABCB1HTR1A
SCHEMBL11815553 0.86 MITF (0.54) MTNR1AMTNR1BABCB1RAB9A
SCHEMBL10202967 0.86 MTNR1A (0.54) MTNR1AMTNR1BTAAR1CYP1A2
SCHEMBL11419614 0.84 MTNR1A (0.46) MTNR1AMTNR1BCYP1A2
SCHEMBL30811394 0.84 ALDH1A1 (0.56) HDAC1RAB9A
SCHEMBL9145931 0.84 ALDH1A1 (0.56) TAAR1L3MBTL1RAB9A

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-20100256394-A1 METHOD FOR THE PREPARATION OF LASOFOXIFENE ZENTIVA K.S. (CZ) 2010-10-07 US disclosed
US-20100256394-A1 METHOD FOR THE PREPARATION OF LASOFOXIFENE ZENTIVA K.S. (CZ) 2010-10-07 US disclosed
WO-2008145075-A2 METHOD FOR THE PREPARATION OF LASOFOXIFENE AND CRYSTALLINE INTERMEDIATES USED THEREIN ZENTIVA, A.S. (CZ) 2008-12-04 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-20100256394-A1 METHOD FOR THE PREPARATION OF LASOFOXIFENE SRD5A1, SRD5A2, CYP19A1 MTNR1A 1695/4885MTNR1B 1678/4885TAAR1 2155/4885

“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.