SCHEMBL360355

SCHEMBL360355

CCCCCCCCCCCCCCC(O)C(O)CN

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SPHK1 Q9NYA1 2/20 0.61
▸ CYP2D6 P10635 2/20 0.57
▸ LMNA P02545 2/20 0.57
▸ HTT P42858 2/20 0.57
▸ GMNN O75496 1/20 0.57
▸ POLB P06746 1/20 0.57
▸ THPO P40225 1/20 0.57
▸ MTOR P42345 1/20 0.57
▸ BLM P54132 1/20 0.57
▸ KDM4E B2RXH2 1/20 0.57
▸ TP53 P04637 1/20 0.57
▸ CYP1A2 P05177 1/20 0.57
▸ CYP3A4 P08684 1/20 0.57
▸ MAPT P10636 1/20 0.57
▸ CETP P11597 1/20 0.57
▸ UBE2N P61088 1/20 0.57
▸ TRPV1 Q8NER1 1/20 0.46
▸ TRPA1 O75762 1/20 0.46
▸ GPR84 Q9NQS5 3/20 0.45
▸ FFAR1 O14842 1/20 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
SCHEMBL8458255 1.00 SPHK1 (0.61) SPHK1CYP2D6LMNAHTTGMNN
SCHEMBL28479718 0.98 SPHK1 (0.58) SPHK1CYP2D6LMNAHTTGMNN
Boric Acid SCHEMBL28300275 0.94 SPHK1 (0.55) SPHK1CYP2D6LMNAHTTGMNN
SCHEMBL28056404 0.90 SPHK1 (0.48) SPHK1CYP2D6LMNAHTTGMNN
SCHEMBL22804904 0.87 SPHK1 (0.68) SPHK1CYP2D6LMNAHTTGMNN
SCHEMBL22805001 0.87 SPHK1 (0.68) SPHK1CYP2D6LMNAHTTGMNN
SCHEMBL22804812 0.87 SPHK1 (0.68) SPHK1CYP2D6LMNAHTTGMNN
SCHEMBL22804976 0.87 SPHK1 (0.68) SPHK1CYP2D6LMNAHTTGMNN
SCHEMBL22804874 0.87 SPHK1 (0.68) SPHK1CYP2D6LMNAHTTGMNN
SCHEMBL22805015 0.87 SPHK1 (0.68) SPHK1CYP2D6LMNAHTTGMNN

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 SPHK1 1311/4885CYP2D6 4643/4885LMNA 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 SPHK1 834/4885CYP2D6 4630/4885LMNA 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.

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