SCHEMBL11260432

SCHEMBL11260432

Cc1ccc(-c2nnc(-c3ccccc3Cl)nn2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 5/20 0.47
ALDH1A1 P00352 4/20 0.46
NPC1 O15118 9/20 0.46
RAB9A P51151 9/20 0.46
SMN1; SMN2 Q16637 6/20 0.46
TP53 P04637 4/20 0.46
HPGD P15428 3/20 0.46
NFKB1 P19838 3/20 0.45
NFKB2 Q00653 3/20 0.45
RELA Q04206 3/20 0.45
KDM4E B2RXH2 2/20 0.45
TSHR P16473 1/20 0.45
CASP3 P42574 1/20 0.45
SENP8 Q96LD8 1/20 0.45
HSD17B10 Q99714 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
LDHA P00338 1/20 0.44
LMNA P02545 1/20 0.43
CYP2A6 P11509 1/20 0.42

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
SCHEMBL11255465 0.84 RAB9A (0.61) HSD11B1ALDH1A1NPC1RAB9ASMN1; SMN2
Clofentezine SCHEMBL74002 0.82 LDHA (0.59) HSD11B1ALDH1A1NPC1RAB9ASMN1; SMN2
Clofentezine SCHEMBL5022593 0.82 LDHA (0.59) HSD11B1ALDH1A1NPC1RAB9ASMN1; SMN2
Clofentezine SCHEMBL29375770 0.82 LDHA (0.59) HSD11B1ALDH1A1NPC1RAB9ASMN1; SMN2
Clofentezine SCHEMBL30917908 0.82 LDHA (0.59) HSD11B1ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL1045000 0.80 CYP2A6 (0.65) HSD11B1ALDH1A1NPC1RAB9ASMN1; SMN2
Clofentezine SCHEMBL28407354 0.80 LDHA (0.57) HSD11B1ALDH1A1NPC1RAB9ASMN1; SMN2
Clofentezine SCHEMBL27980858 0.80 LDHA (0.57) HSD11B1ALDH1A1NPC1RAB9ASMN1; SMN2
Clofentezine SCHEMBL27876726 0.80 LDHA (0.57) HSD11B1ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL22357676 0.79 HSD11B1 (0.52) HSD11B1ALDH1A1NPC1RAB9ASMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0005912-B1 ACARICIDAL, LARVICIDAL AND OVICIDAL TETRAZINE DERIVATIVES AND COMPOSITIONS, PROCESSES FOR THEIR PREPARATION AND METHODS OF USING THEM FBC LIMITED (GB) 1982-07-14 EP claimed
US-4237127-A MITICIDES, LARVICIDES, OVICIDES FISONS LIMITED (GB) 1980-12-02 US claimed
EP-0005912-A1 Acaricidal, larvicidal and ovicidal tetrazine derivatives and compositions, processes for their preparation and methods of using them FBC LIMITED (GB) 1979-12-12 EP claimed
EP-0005912-B1 ACARICIDAL, LARVICIDAL AND OVICIDAL TETRAZINE DERIVATIVES AND COMPOSITIONS, PROCESSES FOR THEIR PREPARATION AND METHODS OF USING THEM FBC LIMITED (GB) 1982-07-14 EP disclosed
US-4237127-A MITICIDES, LARVICIDES, OVICIDES FISONS LIMITED (GB) 1980-12-02 US disclosed
EP-0005912-A1 Acaricidal, larvicidal and ovicidal tetrazine derivatives and compositions, processes for their preparation and methods of using them FBC LIMITED (GB) 1979-12-12 EP disclosed