SCHEMBL16624915

SCHEMBL16624915

CCCCCOC(=O)CC(c1ccccc1)C(C)C(=O)c1ccc(C)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.44
LMNA P02545 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
GAA P10253 1/20 0.43
CYP3A4 P08684 3/20 0.41
TSHR P16473 2/20 0.41
TP53 P04637 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP2C19 P33261 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HPGD P15428 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL16624914 0.93 SMN1; SMN2 (0.47) SMN1; SMN2LMNANPC1RAB9AGAA
SCHEMBL16624910 0.89 SMN1; SMN2 (0.46) SMN1; SMN2LMNANPC1RAB9AGAA
SCHEMBL16624901 0.88 F2 (0.46) LMNANPC1RAB9ACYP3A4TSHR
SCHEMBL16624922 0.86 CYP3A4 (0.41) SMN1; SMN2NPC1RAB9ACYP3A4MAPK1
SCHEMBL19071630 0.85 CYP3A4 (0.39) LMNANPC1RAB9ACYP3A4CYP2C19
SCHEMBL16624908 0.81 KCNA5 (0.53) SMN1; SMN2NPC1RAB9ACYP3A4CYP2C19
SCHEMBL16624893 0.81 MEN1 (0.48) SMN1; SMN2LMNANPC1CYP3A4TSHR
SCHEMBL16624916 0.80 L3MBTL1 (0.46) SMN1; SMN2LMNANPC1RAB9ACYP3A4
SCHEMBL16624891 0.78 LMNA (0.45) SMN1; SMN2LMNANPC1RAB9ACYP3A4
SCHEMBL19071597 0.78 SMN1; SMN2 (0.43) SMN1; SMN2LMNANPC1RAB9AGAA

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
EP-2864284-B1 PHOTOLABILE PRO-FRAGRANCES HENKEL AG & CO KGAA (DE) 2017-07-05 EP disclosed
US-9458081-B2 Photolabile pro-fragrances HENKEL AG & CO. KGAA (DE) 2016-10-04 US disclosed
US-9458081-B2 Photolabile pro-fragrances HENKEL AG & CO. KGAA (DE) 2016-10-04 US disclosed
US-20150099809-A1 PHOTOLABILE PRO-FRAGRANCES HENKEL AG & CO. KGAA (DE) 2015-04-09 US disclosed
US-20150099809-A1 PHOTOLABILE PRO-FRAGRANCES HENKEL AG & CO. KGAA (DE) 2015-04-09 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-20150099809-A1 PHOTOLABILE PRO-FRAGRANCES TRPA1, PSAP, CRY1 SMN1; SMN2 2584/4885LMNA 1058/4885NPC1 4348/4885

“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.