SCHEMBL10826314

SCHEMBL10826314

CNc1ccc(N)c(C)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 7/20 0.57
▸ ALDH1A1 P00352 7/20 0.57
▸ TDP1 Q9NUW8 7/20 0.57
▸ ALOX15 P16050 3/20 0.57
▸ HIF1A Q16665 2/20 0.57
▸ THRB P10828 2/20 0.57
▸ RECQL P46063 2/20 0.57
▸ TSHR P16473 3/20 0.52
▸ S100B P04271 1/20 0.41
▸ MAPK1 P28482 2/20 0.40
▸ SKP2 Q13309 1/20 0.39
▸ HSD17B10 Q99714 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CASP7 P55210 1/20 0.38
▸ TP53 P04637 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ ESR1 P03372 1/20 0.36
▸ AR P10275 1/20 0.36
▸ ESR2 Q92731 1/20 0.36
▸ CASP1 P29466 1/20 0.36

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 SCHEMBL11439401 0.98 CYP3A4 (0.55) CYP3A4ALDH1A1TDP1ALOX15HIF1A
Hydrochloric Acid SCHEMBL11092761 0.98 CYP3A4 (0.55) CYP3A4ALDH1A1TDP1ALOX15HIF1A
SCHEMBL11511767 0.83 CYP3A4 (0.77) CYP3A4ALDH1A1TDP1ALOX15HIF1A
SCHEMBL301920 0.83 ALDH1A1 (0.68) CYP3A4ALDH1A1TDP1ALOX15HIF1A
SCHEMBL24436849 0.81 TDP1 (0.57) CYP3A4ALDH1A1TDP1ALOX15HIF1A
SCHEMBL11280292 0.81 ALDH1A1 (0.52) CYP3A4ALDH1A1TDP1ALOX15HIF1A
SCHEMBL13548437 0.80 TDP1 (0.46) CYP3A4ALDH1A1TDP1ALOX15HIF1A
SCHEMBL30724396 0.80 TDP1 (0.46) CYP3A4ALDH1A1TDP1ALOX15HIF1A
SCHEMBL4356085 0.80 ALDH1A1 (0.66) CYP3A4ALDH1A1TDP1ALOX15HIF1A
SCHEMBL29709 0.79 CYP3A4 (0.71) CYP3A4ALDH1A1TDP1ALOX15HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0146350-A2 Hair treatment composition UNILEVER PLC (GB) 1985-06-26 — — EP claimed
US-4402700-A CONDITIONING CLAIROL INCORPORATED (US) 1983-09-06 — — US claimed
US-4119399-A AQUEOUS, ALKALINE CLAIROL INCORPORATED (US) 1978-10-10 — — US claimed
US-11371029-B2 Methods for producing lipases NOVOZYMES A/S (DK) 2022-06-28 — — US disclosed
EP-3086158-B1 ELECTROWETTING ELEMENT AMAZON EUROPE HOLDING TECH SCS (LU) 2021-07-07 — — EP disclosed
US-20200255812-A1 Methods for Producing Lipases NOVOZYMES A/S (DK) 2020-08-13 — — US disclosed
CN-111295178-A Method for improving color durability of artificially colored hair 莱雅公司 2020-06-16 — — CN disclosed
EP-3351248-A1 COMPOUNDS AND METHODS FOR INHIBITING NHE-MEDIATED ANTIPORT IN THE TREATMENT OF DISORDERS ASSOCIATED WITH FLUID RETENTION OR SALT OVERLOAD AND GASTROINTESTINAL TRACT DISORDERS Ardelyx, Inc. (US) 2018-07-25 — — EP disclosed
US-10014474-B2 Composition for forming gate insulating film, organic thin film transistor, electronic paper, and display device FUJIFILM CORPORATION (JP) 2018-07-03 — — US disclosed
US-9929348-B2 Organic semiconductor composition comprising organic semiconductor material and polymer compound FUJIFILM CORPORATION (JP) 2018-03-27 — — US disclosed
US-9609747-B2 Wiring board FUJIFILM CORPORATION (JP) 2017-03-28 — — US disclosed
US-4425132-A HAIR DYES, APPLYING WITHOUT RINSING L'OREAL (FR) 1984-01-10 — — US disclosed
US-4402700-A CONDITIONING CLAIROL INCORPORATED (US) 1983-09-06 — — US disclosed
EP-0080905-A1 Silver halide color photographic material KONICA CORPORATION (JP) 1983-06-08 — — EP disclosed
US-4289495-A HAIR DYES, STORAGE STABILITY L'OREAL (FR) 1981-09-15 — — US disclosed
US-4212645-A Hair dyeing composition containing an aryldiamine and a substituted catechol LEVER BROTHERS COMPANY (US) 1980-07-15 — — US disclosed
US-4119399-A AQUEOUS, ALKALINE CLAIROL INCORPORATED (US) 1978-10-10 — — US disclosed
US-4096243-A Composition for lightening hair containing an oxidizing agent and certain quaternary amines CLAIROL INCORPORATED (US) 1978-06-20 — — US disclosed
US-4007747-A HAIR DYES SOCIETE ANONYME DITE: L'OREAL (FR) 1977-02-15 — — US disclosed
US-3970423-A PHENYLENEDIAMINE DERIVATIVES CLAIROL INCORPORATED (US) 1976-07-20 — — 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-10014474-B2 Composition for forming gate insulating film, organic thin film transistor, electronic paper, and display device TEC, EPCAM, MIF CYP3A4 2651/4885ALDH1A1 3275/4885TDP1 630/4885

“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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