SCHEMBL2560135

SCHEMBL2560135

O=Cc1c[nH]c2cc(-c3ccccc3F)ccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNKS O95271 1/20 0.53
▸ TNKS2 Q9H2K2 1/20 0.53
▸ CYP2A6 P11509 2/20 0.53
▸ IMPDH2 P12268 1/20 0.53
▸ PIM1 P11309 2/20 0.49
▸ PIM3 Q86V86 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ PLG P00747 1/20 0.46
▸ PLAU P00749 1/20 0.46
▸ ERN1 O75460 1/20 0.42
▸ PTPRC P08575 1/20 0.42
▸ PTPN1 P18031 1/20 0.42
▸ CCNT1 O60563 1/20 0.42
▸ CDK9 P50750 1/20 0.42
▸ HASPIN Q8TF76 1/20 0.42
▸ PIM2 Q9P1W9 1/20 0.40
▸ TRPA1 O75762 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 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
SCHEMBL15330461 0.89 CYP2A6 (0.53) TNKSTNKS2CYP2A6IMPDH2PIM1
SCHEMBL26700816 0.83 TNKS2 (0.53) TNKS2CYP2A6IMPDH2PIM1PIM3
SCHEMBL26700716 0.82 CYP2A6 (0.49) CYP2A6IMPDH2PIM1PIM3KDM4E
SCHEMBL2535062 0.80 CYP2A6 (0.61) TNKS2CYP2A6IMPDH2PIM1PIM3
SCHEMBL7844961 0.79 CYP2A6 (0.57) TNKS2CYP2A6IMPDH2PIM1PIM3
SCHEMBL15331451 0.78 CYP2A6 (0.53) TNKS2CYP2A6IMPDH2PIM1PIM3
SCHEMBL24950462 0.77 TNKS (0.43) TNKSTNKS2KDM4EALDH1A1MAPT
SCHEMBL15301108 0.75 CYP2A6 (0.50) CYP2A6IMPDH2PIM1PIM3KDM4E
SCHEMBL15300674 0.75 PRKAB2 (0.53) CYP2A6IMPDH2PIM1PIM3KDM4E
SCHEMBL187434 0.75 TDO2 (0.64) CYP2A6IMPDH2PIM1PIM3KDM4E

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 7 patents. 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
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 — — US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 — — EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 — — EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 — — US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 — — EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 — — WO disclosed
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