SCHEMBL8716665

SCHEMBL8716665

Cc1cc(Nn2cccc2)ccn1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
UHRF1 Q96T88 1/20 0.42
SMARCA2 P51531 1/20 0.41
SMARCA4 P51532 1/20 0.41
KDR P35968 2/20 0.41
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
SORT1 Q99523 3/20 0.37
TGFBR1 P36897 3/20 0.35
JAK2 O60674 2/20 0.34
GRM5 P41594 2/20 0.34
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 1/20 0.34

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
SCHEMBL883728 0.71
SCHEMBL8710289 0.71 KDR (0.34) UHRF1SMARCA2SMARCA4KDRHDAC3
SCHEMBL27629951 0.70
SCHEMBL2476869 0.70
SCHEMBL10138666 0.70
SCHEMBL2885926 0.70
SCHEMBL7659797 0.69 NPSR1 (0.53) UHRF1SMARCA2SMARCA4KDRHDAC3
SCHEMBL31494286 0.69 NPSR1 (0.53) UHRF1SMARCA2SMARCA4KDRHDAC3
Bromide SCHEMBL16633264 0.68 UHRF1 (0.48) UHRF1SMARCA2SMARCA4KDRHDAC3
Hydrochloric Acid SCHEMBL27472049 0.68 UHRF1 (0.48) UHRF1SMARCA2SMARCA4KDRHDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1184969-C Use of unsubstd and substd. N-(pyrrol-1-yl) pyridinamines as anticonvulsant agents AVENTIS PHARMA INC (US) 2005-01-19 CN claimed
CN-1191486-A Use of unsubstituted and substituted N- (pyrrol-1-yl) pyridinamines as anticonvulsants HOECHST MARION ROUSSEL INC (US) 1998-08-26 CN claimed
EP-0840609-A1 USE OF UNSUBSTITUTED AND SUBSTITUTED N-(PYRROL-1-YL)PYRIDINAMINES AS ANTICONVULSANT AGENTS HOECHST MARION ROUSSEL, INC. (US) 1998-05-13 EP claimed
WO-1997004777-A1 USE OFF UNSUBSTITUTED AND SUBSTITUTED N-(PYRROL-1-YL)PYRIDINAMINES AS ANTICONVULSANT AGENTS HOECHST MARION ROUSSEL, INC. (US) 1997-02-13 WO claimed
CN-1184969-C Use of unsubstd and substd. N-(pyrrol-1-yl) pyridinamines as anticonvulsant agents AVENTIS PHARMA INC (US) 2005-01-19 CN disclosed
CN-1191486-A Use of unsubstituted and substituted N- (pyrrol-1-yl) pyridinamines as anticonvulsants HOECHST MARION ROUSSEL INC (US) 1998-08-26 CN disclosed