SCHEMBL28637685

SCHEMBL28637685

Oc1ccccc1-c1ncnc(-c2ccncc2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.49
TSHR P16473 2/20 0.49
ADORA3 P0DMS8 1/20 0.49
ALOX15 P16050 1/20 0.49
ADORA2B P29275 1/20 0.49
ADORA1 P30542 1/20 0.49
MAPK1 P28482 2/20 0.44
SMN1; SMN2 Q16637 6/20 0.43
CYP19A1 P11511 1/20 0.42
CASP3 P42574 2/20 0.41
SENP8 Q96LD8 2/20 0.41
SENP7 Q9BQF6 2/20 0.41
SENP6 Q9GZR1 2/20 0.41
CHUK O15111 2/20 0.41
TXNRD1 Q16881 2/20 0.41
NOX4 Q9NPH5 2/20 0.41
ALOX5 P09917 1/20 0.41
ALDH1A1 P00352 5/20 0.40
MAPT P10636 3/20 0.40
KDM4E B2RXH2 2/20 0.40

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
SCHEMBL8748157 0.88 TSHR (0.62) ADORA2ATSHRADORA3ALOX15ADORA2B
SCHEMBL21823237 0.86 ADORA2A (0.64) ADORA2ATSHRADORA3ALOX15ADORA2B
SCHEMBL30958361 0.86 ADORA2A (0.64) ADORA2ATSHRADORA3ALOX15ADORA2B
SCHEMBL195151 0.86 SMN1; SMN2 (0.55) ADORA2ATSHRADORA3ALOX15ADORA2B
SCHEMBL29502792 0.86 SMN1; SMN2 (0.55) ADORA2ATSHRADORA3ALOX15ADORA2B
SCHEMBL27881592 0.85 TSHR (0.58) ADORA2ATSHRADORA3ALOX15ADORA2B
SCHEMBL5083129 0.83 ADORA2A (0.57) ADORA2ATSHRADORA3ALOX15ADORA2B
SCHEMBL28926745 0.81 CYP19A1 (0.49) ADORA2ATSHRADORA3ALOX15ADORA2B
SCHEMBL18905390 0.80 NOTUM (0.58) ADORA2ATSHRADORA1MAPK1SMN1; SMN2
SCHEMBL18731945 0.80 MAPT (0.50) TSHRMAPK1SMN1; SMN2CYP19A1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112805274-B Pyridine and pyrimidine substituted triazine ultraviolet light absorbers 亨斯迈纺织染化(瑞士)有限公司 2024-06-25 CN disclosed
CN-112805274-A Novel pyridine and pyrimidine substituted triazine ultraviolet absorbers 亨斯迈先进材料(瑞士)有限公司 2021-05-14 CN disclosed