SCHEMBL9973063

SCHEMBL9973063

CCCC(C)C1CCC(c2ccc(-c3ccc(OC(=O)C4CCC(C(=O)Nc5ccc(C)c(C)c5)CC4)cc3)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPK1 P28482 1/20 0.38
CYP2C19 P33261 1/20 0.38
MCHR1 Q99705 2/20 0.38
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
MAPK14 Q16539 1/20 0.37
ABL1 P00519 3/20 0.37
NPSR1 Q6W5P4 2/20 0.36
POLB P06746 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36

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
SCHEMBL12125156 0.85 MEN1 (0.44) LMNASMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL8771837 0.84 MAPK14 (0.41) LMNASMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL15214810 0.84 PTPN1 (0.47) SMN1; SMN2MEN1KMT2AALDH1A1CYP1A2
SCHEMBL9973051 0.84 KMT2A (0.38) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL9973043 0.82 NPC1 (0.46) MEN1KMT2AALDH1A1MCHR1TP53
SCHEMBL9973153 0.79 HDAC3 (0.48) LMNAKMT2AALDH1A1MAPTMAPK14
SCHEMBL9973104 0.78 HDAC3 (0.51) MEN1KMT2AALDH1A1MCHR1TP53
SCHEMBL9973102 0.76 KMT2A (0.48) MEN1KMT2AALDH1A1MAPK14ABL1
SCHEMBL12127084 0.76 MAPT (0.38) MEN1KMT2AMAPTNPSR1NPC1
SCHEMBL9973053 0.72 MAPT (0.40) MEN1KMT2AMAPTNPSR1POLB

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
WO-2012082383-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 WO disclosed
US-20110279883-A1 POLARIZING PHOTOCHROMIC ARTICLES TRANSITIONS OPTICAL, INC. (US) 2011-11-17 US disclosed
US-20110143141-A1 Photochromic compounds and compositions TRANSITIONS OPTICAL, INC. (US) 2011-06-16 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-20110143141-A1 Photochromic compounds and compositions CCNA1, CRY1, CCNT1 LMNA 230/4885SMN1; SMN2 3964/4885MEN1 437/4885

“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.