SCHEMBL7808559

SCHEMBL7808559

Cn1cccc1-c1cc(N)ccc1N(CCO)CCO

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
PABPC1 P11940 1/20 0.31
KMT2A Q03164 1/20 0.31
PRKCI P41743 1/20 0.30
ADRA1D P25100 1/20 0.30
ADRA1A P35348 1/20 0.30

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
SCHEMBL7807391 0.89 ALDH1A1 (0.34) MEN1KMT2APRKCIADRA1DADRA1A
SCHEMBL7805981 0.84 CRHR1 (0.33)
SCHEMBL7809849 0.82 CETP (0.31) ADRA1DADRA1A
SCHEMBL7808504 0.82 ALDH1A1 (0.33) MEN1PABPC1KMT2A
SCHEMBL7808527 0.81 CRHR1 (0.32) MEN1KMT2A
SCHEMBL7805906 0.80 MAPK1 (0.30)
SCHEMBL7808589 0.80 HTR1A (0.35) MEN1PABPC1KMT2APRKCIADRA1D
SCHEMBL7809781 0.79 ALDH1A1 (0.36) MEN1PABPC1KMT2A
SCHEMBL7807699 0.78 RORC (0.32) MEN1KMT2AADRA1DADRA1A
SCHEMBL7800650 0.78 CRHR1 (0.32) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0943614-B1 Dyeing agents comprising diaminobenzene derivatives and the diaminobenzene derivatives WELLA AG (DE) 2001-12-12 EP disclosed
US-6042620-A FOR DYEING KERATIN FIBERS SUCH AS HAIR WELLA AG (DE) 2000-03-28 US disclosed
EP-0943614-A2 Dyeing agents comprising diaminobenzene derivatives and the diaminobenzene derivatives Wella Aktiengesellschaft (DE) 1999-09-22 EP disclosed