SCHEMBL29958049

SCHEMBL29958049

O=Cc1c[nH]c2c(F)cncc12

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TRIM24 O15164 1/20 0.45
▸ TRIM33 Q9UPN9 1/20 0.45
▸ CYP2A6 P11509 2/20 0.42
▸ IMPDH2 P12268 1/20 0.42
▸ KMT2A Q03164 1/20 0.41
▸ PIM3 Q86V86 10/20 0.41
▸ PIM1 P11309 8/20 0.41
▸ PIM2 Q9P1W9 2/20 0.41
▸ CCNT1 O60563 1/20 0.39
▸ CDK9 P50750 1/20 0.39
▸ HASPIN Q8TF76 1/20 0.39
▸ ERN1 O75460 1/20 0.34
▸ GPR84 Q9NQS5 1/20 0.33

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
SCHEMBL29956158 0.79 TRIM24 (0.62) TRIM24TRIM33CYP2A6IMPDH2KMT2A
SCHEMBL1092989 0.76 TRIM24 (0.64) TRIM24TRIM33CYP2A6IMPDH2KMT2A
SCHEMBL2534005 0.73 GPR84 (0.53) TRIM24TRIM33CYP2A6IMPDH2KMT2A
SCHEMBL19249969 0.72 TDO2 (0.33) PIM3PIM1PIM2GPR84
SCHEMBL22050218 0.72 MPO (0.33) IMPDH2GPR84
SCHEMBL15636281 0.72 CCNT1 (0.34) PIM1CCNT1CDK9HASPINGPR84
SCHEMBL22050219 0.71 CSNK2A2 (0.38) —
SCHEMBL29956329 0.71 CYP2A6 (0.41) CYP2A6IMPDH2KMT2ACCNT1CDK9
Hydrochloric Acid SCHEMBL21988072 0.70 MPO (0.32) IMPDH2GPR84
SCHEMBL21356468 0.70 HTR1A (0.40) TRIM24TRIM33CYP2A6IMPDH2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 — — US disclosed
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