SCHEMBL4423477

SCHEMBL4423477

Cc1c[nH]c2c1ccc1c(C)c[nH]c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.48
REN P00797 2/20 0.40
TRIM24 O15164 1/20 0.38
TRIM33 Q9UPN9 1/20 0.38
BRPF1 P55201 1/20 0.36
HTR2A P28223 1/20 0.35
CCR8 P51685 1/20 0.35
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
PIM3 Q86V86 1/20 0.34
KMT2A Q03164 1/20 0.33
NR4A2 P43354 1/20 0.33
ATAD2 Q6PL18 1/20 0.33
KMO O15229 1/20 0.33
SOS2 Q07890 1/20 0.33
AR P10275 2/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GLA P06280 1/20 0.32

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
SCHEMBL12657696 0.83 TDP1 (0.40) ATMRENTRIM24TRIM33BRPF1
SCHEMBL27360192 0.83 AR (0.49) ATMRENTRIM24TRIM33BRPF1
SCHEMBL2143637 0.79 TRIM24 (0.60) ATMRENTRIM24TRIM33BRPF1
SCHEMBL31607554 0.79 TRIM24 (0.60) ATMRENTRIM24TRIM33BRPF1
SCHEMBL8052787 0.79 ATM (0.38) ATMRENBRPF1SMN1; SMN2KMT2A
SCHEMBL15692504 0.78 REN (0.57) ATMRENTRIM24TRIM33BRPF1
SCHEMBL4430661 0.76 ATM (0.35) ATMRENBRPF1SMN1; SMN2HSD17B10
SCHEMBL4426986 0.76 ATM (0.35) ATMREN
SCHEMBL5248011 0.76 ATM (0.48) ATMRENTRIM24TRIM33BRPF1
SCHEMBL16727192 0.76 DYRK1A (0.53) ATMRENTRIM24TRIM33BRPF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7351266-B2 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2008-04-01 US claimed
US-20050193504-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof PROCTER & GAMBLE COMPANY, THE 2005-09-08 US claimed
EP-1720615-B1 COSMETIC HAIR DYEING COMPOSITIONS CONTAINING THEM AND USE THEREOF PROCTER & GAMBLE (US) 2009-12-30 EP disclosed
US-7468080-B2 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2008-12-23 US disclosed
US-20080134450-A1 Keratin Dyeing Compounds, Keratin Dyeing Compositions Containing Them, And Use Thereof WELLA OPERATIONS US, LLC 2008-06-12 US disclosed
US-7351266-B2 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2008-04-01 US disclosed
US-20050193504-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof PROCTER & GAMBLE COMPANY, THE 2005-09-08 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 (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-20050193504-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof KRT18, CKMT1A; CKMT1B, KRTCAP2 ATM 2846/4885REN 1930/4885TRIM24 2953/4885
US-20080134450-A1 Keratin Dyeing Compounds, Keratin Dyeing Compositions Containing Them, And Use Thereof KRT18, CKMT1A; CKMT1B, KRTCAP2 ATM 2846/4885REN 1930/4885TRIM24 2953/4885

“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.