SCHEMBL11600644

SCHEMBL11600644

O=c1n(CCO)c2cc(Br)c(Br)cc2n1CCO

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.35
▸ LMNA P02545 2/20 0.35
▸ PABPC1 P11940 1/20 0.35
▸ PDE4A P27815 1/20 0.34
▸ PDE4B Q07343 1/20 0.34
▸ PDE4C Q08493 1/20 0.34
▸ PDE4D Q08499 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ THRB P10828 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ CCNB2 O95067 1/20 0.32
▸ CDK1 P06493 1/20 0.32
▸ CCNB1 P14635 1/20 0.32
▸ GSK3B P49841 1/20 0.32
▸ CCNB3 Q8WWL7 1/20 0.32
▸ MAT2A P31153 1/20 0.31

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
SCHEMBL11807935 0.82 HSD17B10 (0.32) HSD17B10ALDH1A1LMNAPDE4APDE4B
SCHEMBL11737976 0.81 CCNB2 (0.41) ALDH1A1KDM4ETSHRCCNB2CDK1
SCHEMBL11810514 0.79 PRKCA (0.35) ALDH1A1PABPC1KDM4EGSK3BGAA
SCHEMBL11603805 0.79 P2RX3 (0.40) HSD17B10ALDH1A1LMNAPDE4APDE4B
SCHEMBL11735743 0.78 MAT2A (0.31) KMT2AMAT2A
SCHEMBL3697820 0.74 APEX1 (0.55) ALDH1A1TSHRGAAPOLBMAPT
SCHEMBL35878 0.74 PDE4A (0.39) HSD17B10ALDH1A1LMNAPDE4APDE4B
SCHEMBL6060518 0.73 KMT2A (0.50) HSD17B10ALDH1A1LMNAKDM4EMEN1
SCHEMBL3703865 0.70 CSNK2A2 (0.41) HSD17B10ALDH1A1LMNAPDE4APDE4B
Formaldehyde SCHEMBL8709282 0.69 CYP3A4 (0.38) HSD17B10ALDH1A1LMNAPDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3954790-A USED TO PRODUCE HEAT-STABLE, FLAME-RESISTANT POLYMERS CIBA-GEIGY CORPORATION (US) 1976-05-04 — — US claimed
US-4066626-A LINEAR POLYESTERS BASED ON HETEROCYCLIC DICARBOXYLIC ACIDS CIBA-GEIGY CORPORATION (US) 1978-01-03 — — US disclosed
US-4038255-A TOUGHNESS CIBA-GEIGY CORPORATION (US) 1977-07-26 — — US disclosed
US-4034019-A OR ISOPHTHALIC ACIDMOLDING MATERIALS, COATINGS CIGA-GEIGY CORPORATION (US) 1977-07-05 — — US disclosed
US-4034018-A Linear polyesters based on s-triazinedicarboxylic acids CIBA-GEIGY CORPORATION (US) 1977-07-05 — — US disclosed
US-3997510-A CONTAINING BENZIMIDAZOLONE RADICAL CIBA-GEIGY CORPORATION (US) 1976-12-14 — — US disclosed
US-3994865-A MELT SPINNING CIBA-GEIGY CORPORATION (US) 1976-11-30 — — US disclosed
US-3954790-A USED TO PRODUCE HEAT-STABLE, FLAME-RESISTANT POLYMERS CIBA-GEIGY CORPORATION (US) 1976-05-04 — — US disclosed
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