SCHEMBL10594682

SCHEMBL10594682

Clc1ccnc(-c2cccc(C(Cl)Cl)c2)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.36
▸ CLK4 Q9HAZ1 5/20 0.34
▸ DYRK1A Q13627 2/20 0.34
▸ LMNA P02545 3/20 0.33
▸ CYP1A2 P05177 4/20 0.33
▸ CYP3A4 P08684 4/20 0.33
▸ PIK3CD O00329 3/20 0.33
▸ PIK3CA P42336 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ ALOX15 P16050 2/20 0.33
▸ TSHR P16473 1/20 0.32
▸ MAPKAPK2 P49137 1/20 0.32
▸ TP53 P04637 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ MAPK1 P28482 3/20 0.32
▸ CYP2D6 P10635 2/20 0.32
▸ CYP2C19 P33261 2/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ MAPT P10636 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
SCHEMBL8344326 0.80 CYP19A1 (0.54) CYP19A1ALDH1A1TSHRTP53SMN1; SMN2
SCHEMBL10594550 0.77 METAP2 (0.40) CYP19A1CLK4DYRK1ALMNACYP1A2
SCHEMBL29786739 0.77 RAB9A (0.50) CLK4LMNACYP1A2CYP3A4ALDH1A1
SCHEMBL10595789 0.77 RAB9A (0.50) CLK4LMNACYP1A2CYP3A4ALDH1A1
SCHEMBL27854208 0.77 KMO (0.44) CYP3A4MAPKAPK2TP53MAPT
SCHEMBL1673203 0.75 LMNA (0.50) LMNASMN1; SMN2MAPK1MAPTNPC1
SCHEMBL25260413 0.73 CLK4 (0.68) CYP19A1CLK4DYRK1ALMNACYP1A2
SCHEMBL31230006 0.73 CLK4 (0.68) CYP19A1CLK4DYRK1ALMNACYP1A2
SCHEMBL10593988 0.73 DYRK1A (0.46) CYP19A1CLK4DYRK1ALMNACYP1A2
SCHEMBL29206336 0.73 KMO (0.48) DYRK1ACYP1A2CYP3A4ALDH1A1ALOX15

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-0132851-B1 5-SUBSTITUTED(1,2,4)TRIAZOLO(1,5-C)PYRIMIDIN-2-AMINES AMERICAN CYANAMID COMPANY (US) 1989-10-04 — — EP disclosed
US-4579848-A ANTIASTHMA AGENTS AMERICAN CYANAMID COMPANY (US) 1986-04-01 — — US disclosed
EP-0132851-A1 5-Substituted(1,2,4)triazolo(1,5-c)pyrimidin-2-amines AMERICAN CYANAMID COMPANY (US) 1985-02-13 — — EP disclosed
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