SCHEMBL10520071

SCHEMBL10520071

Cc1cc2cc3c(nc2s1)sc1c(=O)[nH]nnc13

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ ALDH1A1 P00352 4/20 0.40
▸ HPGD P15428 3/20 0.40
▸ KDM4E B2RXH2 3/20 0.33
▸ POLB P06746 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ CHEK1 O14757 1/20 0.31
▸ PIM1 P11309 2/20 0.30
▸ PIM2 Q9P1W9 2/20 0.30
▸ MAPT P10636 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
SCHEMBL10633051 0.76 CHEK2 (0.41) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL10632720 0.74 SRC (0.44) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL10522462 0.71 MEN1 (0.35) MEN1KMT2AALDH1A1HPGD
SCHEMBL10639291 0.71 KMT2A (0.33) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL17950473 0.66 CDC7 (0.33) MEN1KMT2AALDH1A1HPGD
SCHEMBL4757582 0.66 ALDH1A1 (0.37) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL23327604 0.63 MEN1 (0.39) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL10521662 0.62 IKBKB (0.58) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL25170501 0.60 PDPK1 (0.54) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL5435622 0.60 KDM4E (0.60) ALDH1A1HPGDKDM4EMAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0177065-B1 THIENOTRIAZINES MERRELL DOW PHARMACEUTICALS INC. (US) 1989-03-29 — — EP claimed
EP-0177065-A1 Thienotriazines MERRELL DOW PHARMACEUTICALS INC. (US) 1986-04-09 — — EP claimed
US-4581448-A Thienotriazines MERRELL DOW PHARMACEUTICALS INC. (US) 1986-04-08 — — US claimed
EP-0177065-B1 THIENOTRIAZINES MERRELL DOW PHARMACEUTICALS INC. (US) 1989-03-29 — — EP disclosed
US-4581448-A Thienotriazines MERRELL DOW PHARMACEUTICALS INC. (US) 1986-04-08 — — US disclosed
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