SCHEMBL1977774

SCHEMBL1977774

CCCCCCNCC=CCl

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 5/20 0.56
TSHR P16473 2/20 0.50
ALDH1A1 P00352 1/20 0.50
EPHX1 P07099 4/20 0.46
ADH1B P00325 2/20 0.46
ADH1C P00326 2/20 0.46
ADH1A P07327 2/20 0.46
ADH7 P40394 2/20 0.46
ADH4 P08319 1/20 0.46
S1PR2 O95136 5/20 0.38
S1PR4 O95977 5/20 0.38
S1PR1 P21453 5/20 0.38
S1PR3 Q99500 5/20 0.38
S1PR5 Q9H228 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
TRPV1 Q8NER1 1/20 0.35

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
Hydrochloric Acid SCHEMBL312840 0.98 KDM1A (0.54) KDM1ATSHRALDH1A1EPHX1ADH1B
SCHEMBL8938918 0.81
SCHEMBL8938917 0.81
SCHEMBL24157573 0.80 KDM1A (0.64) KDM1ATSHRALDH1A1EPHX1ADH1B
SCHEMBL22157514 0.80 KDM1A (0.58) KDM1ATSHRALDH1A1EPHX1ADH1B
SCHEMBL20037699 0.80 KDM1A (0.58) KDM1ATSHRALDH1A1EPHX1ADH1B
Hydrochloric Acid SCHEMBL9052774 0.79
Hydrochloric Acid SCHEMBL9052779 0.79
SCHEMBL9213042 0.78 KDM1A (0.61) KDM1ATSHRALDH1A1EPHX1ADH1B
SCHEMBL10827259 0.78 KDM1A (0.56) KDM1ATSHRALDH1A1EPHX1ADH1B

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1269985-B1 Wipe and uses thereof in the cosmetics field OREAL (FR) 2005-11-30 EP claimed
EP-1269985-A1 Wipe and uses thereof in the cosmetics field L'OREAL (FR) 2003-01-02 EP claimed
EP-0976384-B1 Cosmetic and/or dermatological biphasic composition for eyes make-up removal OREAL (FR) 2001-07-25 EP claimed
EP-0976384-A1 Cosmetic and/or dermatological biphasic composition for eyes make-up removal L'OREAL (FR) 2000-02-02 EP claimed
EP-0850634-B1 Preservative system and its use in a cosmetic or pharmaceutical composition OREAL (FR) 1999-05-26 EP claimed
EP-0850634-A1 Preservative system and its use in a cosmetic or pharmaceutical composition L'OREAL (FR) 1998-07-01 EP claimed
US-20190110977-A1 PROCESS FOR TREATMENT OF KERATINOUS MATERIALS AND KIT FOR FORMULATION OF A COSMETIC PRODUCT L'OREAL (FR) 2019-04-18 US disclosed
EP-2335683-B1 Cosmetic kit formulation L'ORÉAL (FR) 2018-02-28 EP disclosed
CN-106132531-A Improvements in or relating to organic compounds 奇华顿股份有限公司 2016-11-16 CN disclosed
CN-1606618-B Novel alkali protease formed by bacillus gibsonii (DSM 14393) and washing and cleaning agents containing said novel alkali protease HENKEL KGAA 2013-03-13 CN disclosed
EP-2335683-A1 Cosmetic kit formulation L'Oréal (FR) 2011-06-22 EP disclosed
US-20110142897-A1 PROCESS FOR TREATMENT OF KERATINOUS MATERIALS AND KIT FOR FORMULATION OF A COSMETIC PRODUCT L'OREAL (FR) 2011-06-16 US disclosed
CN-1608129-B Alkaline protease from bacillus sp. (DSM 14392) and uses thereof HENKEL KGAA 2010-06-16 CN disclosed
EP-0976384-B1 Cosmetic and/or dermatological biphasic composition for eyes make-up removal OREAL (FR) 2001-07-25 EP disclosed
EP-0976384-A1 Cosmetic and/or dermatological biphasic composition for eyes make-up removal L'OREAL (FR) 2000-02-02 EP disclosed
EP-0976384-A1 Cosmetic and/or dermatological biphasic composition for eyes make-up removal L'OREAL (FR) 2000-02-02 EP disclosed
EP-0850634-B1 Preservative system and its use in a cosmetic or pharmaceutical composition OREAL (FR) 1999-05-26 EP disclosed
US-5900227-A CAN BE REACTED WITH A FREE RADICAL IN SOLUTION TO FORM A SPIN ADDUCT WHICH IS STABLE AND READILY DETECTABLE BY ELECTRON PARAMAGNETIC RESONANCE (EPR) SPECTROSCOPY. OKLAHOMA MEDICAL RESEARCH FOUNDATION (US) 1999-05-04 US disclosed
EP-0850634-A1 Preservative system and its use in a cosmetic or pharmaceutical composition L'OREAL (FR) 1998-07-01 EP disclosed
EP-0850634-A1 Preservative system and its use in a cosmetic or pharmaceutical composition L'OREAL (FR) 1998-07-01 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-20190110977-A1 PROCESS FOR TREATMENT OF KERATINOUS MATERIALS AND KIT FOR FORMULATION OF A COSMETIC PRODUCT CUTA, KRT18, KIT KDM1A 443/4885TSHR 3836/4885ALDH1A1 1955/4885
US-20110142897-A1 PROCESS FOR TREATMENT OF KERATINOUS MATERIALS AND KIT FOR FORMULATION OF A COSMETIC PRODUCT CUTA, KRT18, KIT KDM1A 443/4885TSHR 3836/4885ALDH1A1 1955/4885

“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.