SCHEMBL7124897

SCHEMBL7124897

CCCCCCNc1cc(Cl)nc(N)n1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.62
CYP2C19 P33261 1/20 0.62
TLR8 Q9NR97 5/20 0.60
HRH4 Q9H3N8 2/20 0.53
ALDH1A1 P00352 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
DNM2 P50570 8/20 0.44
KMT2A Q03164 1/20 0.43

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
SCHEMBL16703349 1.00 CYP2D6 (0.62) CYP2D6CYP2C19TLR8HRH4ALDH1A1
SCHEMBL7117794 1.00 CYP2D6 (0.62) CYP2D6CYP2C19TLR8HRH4ALDH1A1
SCHEMBL7135338 1.00 CYP2D6 (0.62) CYP2D6CYP2C19TLR8HRH4ALDH1A1
SCHEMBL7118699 1.00 CYP2D6 (0.62) CYP2D6CYP2C19TLR8HRH4ALDH1A1
Hydrochloric Acid SCHEMBL11755133 0.98 CYP2D6 (0.60) CYP2D6CYP2C19TLR8HRH4ALDH1A1
SCHEMBL11752857 0.98 CYP2D6 (0.64) CYP2D6CYP2C19TLR8HRH4ALDH1A1
SCHEMBL8600881 0.94 TLR8 (0.69) CYP2D6CYP2C19TLR8HRH4ALDH1A1
SCHEMBL8597545 0.87 CYP2D6 (0.70) CYP2D6CYP2C19TLR8HRH4ALDH1A1
SCHEMBL30263108 0.84 TLR8 (0.64) CYP2D6CYP2C19TLR8HRH4DNM2
SCHEMBL29156884 0.84 TLR8 (0.64) CYP2D6CYP2C19TLR8HRH4DNM2

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-6511659-B2 Treatment of alopecia, cosmetics SOCIETE L'OREAL S.A. (FR) 2003-01-28 US claimed
US-4025515-A HERBICIDES SANDOZ LTD. (CH) 1977-05-24 US claimed
US-6653317-B2 Pyrimidine 3-oxide compounds for inducing/stimulating hair growth and/or retarding hair loss SOCIETE L'OREAL S.A. (FR) 2003-11-25 US disclosed
US-20030130294-A1 Pyrimidine 3-oxide compounds for inducing/stimulating hair growth and/or retarding hair loss MAHE YANN (FR) 2003-07-10 US disclosed
US-6511659-B2 Treatment of alopecia, cosmetics SOCIETE L'OREAL S.A. (FR) 2003-01-28 US disclosed
US-20010044444-A1 Pyrimidine 3-oxide compounds for inducing/stimulating hair growth and/or retarding hair loss MAHE YANN (FR) 2001-11-22 US disclosed
US-6291468-B1 Pyrimidine 3-oxide compounds for inducing/stimulating hair growth and/or retarding hair loss SOCIETE L'OREAL S.A. (FR) 2001-09-18 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-20030130294-A1 Pyrimidine 3-oxide compounds for inducing/stimulating hair growth and/or retarding hair loss TK2, TYR, MTR CYP2D6 1449/4885CYP2C19 1927/4885TLR8 3325/4885
US-20010044444-A1 Pyrimidine 3-oxide compounds for inducing/stimulating hair growth and/or retarding hair loss TK2, TYR, MTR CYP2D6 1377/4885CYP2C19 1902/4885TLR8 3364/4885

“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.