SCHEMBL25670293

SCHEMBL25670293

Cn1ccc2c(c(N)cn2C)c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 3/20 0.34
TAF1 P21675 1/20 0.34
BRPF1 P55201 1/20 0.34
CREBBP Q92793 1/20 0.34
CECR2 Q9BXF3 1/20 0.34
BRD9 Q9H8M2 1/20 0.34
AURKA O14965 1/20 0.34
TTK P33981 1/20 0.34
AURKB Q96GD4 1/20 0.34
INCENP Q9NQS7 1/20 0.34
PRKCI P41743 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C9 P11712 1/20 0.32
ZAP70 P43403 1/20 0.32
CRBN Q96SW2 1/20 0.31
ATAD2 Q6PL18 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 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
Hydrochloric Acid SCHEMBL27199525 0.98 BRD4 (0.33) BRD4TAF1BRPF1CREBBPCECR2
SCHEMBL25670818 0.81 ALDH1A1 (0.33) AURKATTKAURKBINCENPKDM4E
Hydrochloric Acid SCHEMBL27199567 0.80 CCNT1 (0.32) ALDH1A1
Hydrochloric Acid SCHEMBL27199382 0.80 ALDH1A1 (0.33) MAPTKDM4EALDH1A1GAA
SCHEMBL25752565 0.79 DHODH (0.34) BRD4MAPTCYP2C9KDM4EALDH1A1
SCHEMBL23487979 0.77 BRD4 (0.34) BRD4TAF1BRPF1CREBBPCECR2
SCHEMBL25670290 0.77 BRD4 (0.34) BRD4TAF1BRPF1CREBBPCECR2
Hydrochloric Acid SCHEMBL27199587 0.75 MEN1 (0.33)
Hydrochloric Acid SCHEMBL27199321 0.75 ALDH1A1 (0.36) MAPTCYP2C9KDM4EALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL27199639 0.75 ALDH1A1 (0.34) BRD4KDM4EALDH1A1GAA

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
WO-2023109120-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2023-06-22 WO disclosed
WO-2023108536-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2023-06-22 WO disclosed