SCHEMBL360356

SCHEMBL360356

CCCCCCCCCCCCCCC(N)C(O)CO

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 4/20 0.70
SPHK1 Q9NYA1 4/20 0.70
LMNA P02545 4/20 0.70
MAPT P10636 4/20 0.70
GMNN O75496 3/20 0.70
POLB P06746 3/20 0.70
BLM P54132 3/20 0.70
CETP P11597 3/20 0.70
UBE2N P61088 3/20 0.70
THPO P40225 2/20 0.70
TP53 P04637 2/20 0.70
CYP1A2 P05177 2/20 0.70
MTOR P42345 1/20 0.70
KDM4E B2RXH2 1/20 0.70
CYP3A4 P08684 1/20 0.70
HTT P42858 1/20 0.70
NOS2 P35228 2/20 0.55
CSNK1E P49674 1/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46

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
SCHEMBL28584076 1.00 CYP2D6 (0.70) CYP2D6SPHK1LMNAMAPTGMNN
SCHEMBL1131956 1.00 CYP2D6 (0.70) CYP2D6SPHK1LMNAMAPTGMNN
SCHEMBL8455217 1.00 CYP2D6 (0.70) CYP2D6SPHK1LMNAMAPTGMNN
SCHEMBL27938464 1.00 CYP2D6 (0.70) CYP2D6SPHK1LMNAMAPTGMNN
Hydrochloric Acid SCHEMBL9575893 0.98 CYP2D6 (0.68) CYP2D6SPHK1LMNAMAPTGMNN
Ammonia Solution, Strong SCHEMBL28467048 0.98 CYP2D6 (0.68) CYP2D6SPHK1LMNAMAPTGMNN
SCHEMBL1132289 0.98 CYP2D6 (0.67) CYP2D6SPHK1LMNAMAPTGMNN
SCHEMBL6118653 0.86 CYP2D6 (0.76) CYP2D6SPHK1LMNAMAPTGMNN
SCHEMBL16859677 0.86 CYP2D6 (0.76) CYP2D6SPHK1LMNAMAPTGMNN
SCHEMBL6118549 0.86 CYP2D6 (0.76) CYP2D6SPHK1LMNAMAPTGMNN

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8937100-B2 Cosmetic composition containing calcium citrate and N-acylated aminoalcohol derivative COGNIS IP MANAGEMENT GMBH (DE) 2015-01-20 US claimed
US-20140086863-A1 Cosmetic Composition COGNIS IP MANAGEMENT GMBH (DE) 2014-03-27 US claimed
US-8592484-B2 Cosmetic composition containing calcium citrate and N-acylated aminoalcohol derivative to prevent dry skin and signs of cutaneous ageing COGNIS IP MANAGEMENT GMBH (DE) 2013-11-26 US claimed
EP-2410977-B1 COSMETIC COMPOSITION CONTAINING CALCIUM CITRATE AND N-ACYLATED AMINOALCOHOL DERIVATIVE TO PREVENT DRY SKIN AND SIGNS OF CUTANEOUS AGEING COGNIS IP MAN GMBH (DE) 2015-05-13 EP disclosed
US-8937100-B2 Cosmetic composition containing calcium citrate and N-acylated aminoalcohol derivative COGNIS IP MANAGEMENT GMBH (DE) 2015-01-20 US disclosed
US-20140086863-A1 Cosmetic Composition COGNIS IP MANAGEMENT GMBH (DE) 2014-03-27 US disclosed
US-8592484-B2 Cosmetic composition containing calcium citrate and N-acylated aminoalcohol derivative to prevent dry skin and signs of cutaneous ageing COGNIS IP MANAGEMENT GMBH (DE) 2013-11-26 US disclosed
EP-2410977-A1 COSMETIC COMPOSITION CONTAINING CALCIUM CITRATE AND N-ACYLATED AMINOALCOHOL DERIVATIVE TO PREVENT DRY SKIN AND SIGNS OF CUTANEOUS AGEING Cognis IP Management GmbH (DE) 2012-02-01 EP disclosed
US-20120016032-A1 Cosmetic Composition Containing Calcium Citrate And N-Acylated Aminoalcohol Derivative To Prevent Dry Skin And Signs Of Cutaneous Ageing COGNIS IP MANAGEMENT GMBH (DE) 2012-01-19 US disclosed
WO-2010108619-A1 COSMETIC COMPOSITION CONTAINING CALCIUM CITRATE AND N-ACYLATED AMINOALCOHOL DERIVATIVE TO PREVENT DRY SKIN AND SIGNS OF CUTANEOUS AGEING COGNIS IP MANAGEMENT GMBH (DE) 2010-09-30 WO disclosed
EP-2233128-A1 Cosmetic composition Cognis IP Management GmbH (DE) 2010-09-29 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 (2 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-20140086863-A1 Cosmetic Composition ASAH2, ASAH1, GLA CYP2D6 4643/4885SPHK1 1311/4885LMNA 1670/4885
US-20120016032-A1 Cosmetic Composition Containing Calcium Citrate And N-Acylated Aminoalcohol Derivative To Prevent Dry Skin And Signs Of Cutaneous Ageing ASAH2, ASAH1, GLA CYP2D6 4630/4885SPHK1 834/4885LMNA 1781/4885

“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.