SCHEMBL8090787

SCHEMBL8090787

Oc1cccc(NC2CCCCC2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.46
TSHR P16473 2/20 0.46
PDK2 Q15119 1/20 0.45
IDO1 P14902 1/20 0.44
STS P08842 1/20 0.43
ALDH1A1 P00352 3/20 0.43
MAPT P10636 2/20 0.43
MAPK1 P28482 2/20 0.43
LMNA P02545 2/20 0.43
RAPGEF4 Q8WZA2 1/20 0.43
KMT2A Q03164 5/20 0.43
MEN1 O00255 4/20 0.43
KDM4E B2RXH2 1/20 0.43
APAF1 O14727 1/20 0.43
BLM P54132 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
CYP1A2 P05177 2/20 0.42

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
SCHEMBL10346526 1.00 CYP3A4 (0.46) CYP3A4TSHRPDK2IDO1STS
SCHEMBL10346361 1.00 CYP3A4 (0.46) CYP3A4TSHRPDK2IDO1STS
SCHEMBL31195429 1.00 CYP3A4 (0.46) CYP3A4TSHRPDK2IDO1STS
SCHEMBL126258 0.98 CYP3A4 (0.47) CYP3A4TSHRPDK2IDO1STS
Cyclohexanone SCHEMBL10801298 0.89 PDK2 (0.44) CYP3A4TSHRPDK2STSALDH1A1
Cycloheptanone SCHEMBL10800897 0.89 PDK2 (0.44) CYP3A4TSHRPDK2STSALDH1A1
SCHEMBL4583083 0.87 RAPGEF4 (0.41) CYP3A4TSHRPDK2STSALDH1A1
SCHEMBL3427795 0.86 KDM4E (0.49) CYP3A4TSHRALDH1A1MAPTMAPK1
SCHEMBL3768702 0.84 KDM4E (0.46) CYP3A4TSHRALDH1A1MAPTMAPK1
SCHEMBL10346907 0.82 RAPGEF4 (0.45) CYP3A4TSHRALDH1A1MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5104412-A With N-cycloalkyl-3-aminophenols as coupling compounds; colorfast brown, heat, light, chemical resistance HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1992-04-14 US claimed
JP-3240761-A None JP disclosed
JP-4001160-A None JP disclosed
JP-5078610-A None JP disclosed
JP-3240758-A None JP disclosed
JP-62000528-A None JP disclosed
JP-4077460-A None JP disclosed
US-20160263125-A1 AMINO, AMIDO AND HETEROCYCLIC COMPOUNDS AS MODULATORS OF RAGE ACTIVITY AND USES THEREOF NEW YORK UNIVERSITY 2016-09-15 US disclosed
US-20160263125-A1 AMINO, AMIDO AND HETEROCYCLIC COMPOUNDS AS MODULATORS OF RAGE ACTIVITY AND USES THEREOF NEW YORK UNIVERSITY 2016-09-15 US disclosed
US-9364472-B2 Amino, Amido and heterocyclic compounds as modulators of RAGE activity and uses thereof NEW YORK UNIVERSITY (US) 2016-06-14 US disclosed
EP-0411817-A2 Process for preparing N-alkyl-substituted aminophenols SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-02-06 EP disclosed
EP-0181505-B1 IMPROVED METHOD FOR PRODUCING CYCLOALKYL AMINOPHENOL DERIVATIVES KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1990-03-28 EP disclosed
WO-1990000046-A1 HAIR-DYING AGENT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1990-01-11 WO disclosed
EP-0348849-A1 Hairdying composition Henkel Kommanditgesellschaft auf Aktien (DE) 1990-01-03 EP disclosed
US-4713488-A REACTING AMINOPHENOLS AND CYCLOALKANONES IN THE PRESENCE OF A REDUCING AGENT KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1987-12-15 US disclosed
JP-S62528-A POLYAMIDE ESTER AND LIQUID CRYSTAL DISPLAY ELEMENT PREPARED THEREFROM RICOH CO LTD 1987-01-06 JP disclosed
EP-0181505-A1 Improved method for producing cycloalkyl aminophenol derivatives KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1986-05-21 EP disclosed
EP-0048222-B1 STABILISATION OF THERMOPLASTICS THAT CONTAIN CHLORINE WITH M-AMINO PHENOLS CIBA-GEIGY AG (CH) 1984-12-27 EP disclosed
US-4385147-A Stabilization of chlorine-containing thermoplastics with m-aminophenol derivatives CIBA-GEIGY CORPORATION (US) 1983-05-24 US disclosed
EP-0048222-A1 Stabilisation of thermoplastics that contain chlorine with m-amino phenols CIBA-GEIGY AG (CH) 1982-03-24 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 (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-20160263125-A1 AMINO, AMIDO AND HETEROCYCLIC COMPOUNDS AS MODULATORS OF RAGE ACTIVITY AND USES THEREOF AGER, IAPP, GPR119 CYP3A4 4102/4885TSHR 2272/4885PDK2 2430/4885

“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.