SCHEMBL3168294

SCHEMBL3168294

CCCNc1ccc2c(c1N)C(=O)c1ccccc1C2=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 7/20 0.54
▸ SMN1; SMN2 Q16637 5/20 0.54
▸ ALDH1A1 P00352 4/20 0.54
▸ L3MBTL1 Q9Y468 4/20 0.54
▸ RAB9A P51151 3/20 0.54
▸ NPC1 O15118 2/20 0.54
▸ CYP3A4 P08684 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ CASP3 P42574 1/20 0.54
▸ HBB P68871 1/20 0.54
▸ SENP7 Q9BQF6 1/20 0.54
▸ SENP6 Q9GZR1 1/20 0.54
▸ MAOA P21397 3/20 0.53
▸ MAOB P27338 1/20 0.53
▸ MAPT P10636 6/20 0.50
▸ MEN1 O00255 5/20 0.50
▸ POLB P06746 5/20 0.50
▸ KMT2A Q03164 5/20 0.50
▸ LMNA P02545 3/20 0.50
▸ THRB P10828 2/20 0.50

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
SCHEMBL11648905 0.83 MEN1 (0.46) MAPK1SMN1; SMN2ALDH1A1L3MBTL1RAB9A
SCHEMBL29940221 0.82 POLB (0.63) MAPK1SMN1; SMN2ALDH1A1L3MBTL1RAB9A
SCHEMBL11131632 0.82 POLB (0.63) MAPK1SMN1; SMN2ALDH1A1L3MBTL1RAB9A
SCHEMBL10781791 0.81 MAPT (0.62) MAPK1SMN1; SMN2ALDH1A1L3MBTL1RAB9A
SCHEMBL28287515 0.81 ADORA2A (0.58) MAPK1SMN1; SMN2ALDH1A1L3MBTL1RAB9A
SCHEMBL27496947 0.79 MAOA (0.53) MAPK1SMN1; SMN2ALDH1A1L3MBTL1RAB9A
Methylamine SCHEMBL10780560 0.79 ADORA2A (0.56) MAPK1SMN1; SMN2ALDH1A1L3MBTL1RAB9A
SCHEMBL6390809 0.79 P2RY4 (0.46) MAPK1SMN1; SMN2L3MBTL1RAB9ANPC1
SCHEMBL14582002 0.77 POLB (0.56) MAPK1SMN1; SMN2ALDH1A1L3MBTL1RAB9A
SCHEMBL6372565 0.76 NSD2 (0.58) MAPK1SMN1; SMN2ALDH1A1L3MBTL1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110035739-B Dye composition comprising 12-hydroxystearic acid, an organic amine and a dye 欧莱雅 2022-05-10 — — CN disclosed
EP-3883539-A1 AZOMETHINE DYE CHROMOPHORES BASF SE (DE) 2021-09-29 — — EP disclosed
US-20100005600-A1 PROCESS FOR TREATING KERATIN FIBRES BY APPLYING HEAT L'OREAL S.A. 2010-01-14 — — US disclosed
US-7608115-B2 Process for treating keratin fibres by applying heat L'OREAL S.A. (FR) 2009-10-27 — — US disclosed
US-20070174974-A1 Process for treating keratin fibres by applying heat L'OREAL S.A. (FR) 2007-08-02 — — US disclosed
EP-1631241-A1 PROCESS FOR TREATING KERATIN FIBRES BY APPLYING HEAT L'OREAL (FR) 2006-03-08 — — EP disclosed
WO-2004098550-A1 PROCESS FOR TREATING KERATIN FIBRES BY APPLYING HEAT L'OREAL (FR) 2004-11-18 — — WO disclosed
US-4695653-A Cationic surface-active agents L'OREAL (FR) 1987-09-22 — — US disclosed
US-4436909-A HAIR COSMETICS L'OREAL (FR) 1984-03-13 — — US disclosed
US-4220602-A FOR HAIR COSMETICS L'OREAL (FR) 1980-09-02 — — US disclosed
US-4096332-A POLYHYDROXYLATED TERTIARY AMINES OR QUATERNARY AMMONIUM SALTS THEREOF L'OREAL (FR) 1978-06-20 — — US disclosed
US-4009255-A POLYHYDROXYLATED TERTIARY AMINES SOCIETE ANONYME DITE: L'OREAL (FR) 1977-02-22 — — 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-20100005600-A1 PROCESS FOR TREATING KERATIN FIBRES BY APPLYING HEAT KRT18, FECH, HSPD1 MAPK1 2556/4885SMN1; SMN2 4800/4885ALDH1A1 866/4885
US-20070174974-A1 Process for treating keratin fibres by applying heat KRT18, FECH, HSPD1 MAPK1 2556/4885SMN1; SMN2 4800/4885ALDH1A1 866/4885

“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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