SCHEMBL8546241

SCHEMBL8546241

CCOC(=O)c1[nH]c2cc(C(F)(F)F)ccc2c1N(C)CC(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 5/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
POLB P06746 1/20 0.42
TMEM97 Q5BJF2 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
KDM4E B2RXH2 2/20 0.41
RAB9A P51151 2/20 0.41
HTR1A P08908 1/20 0.41
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
HTR1D P28221 1/20 0.41
HTR1B P28222 1/20 0.41
HTR1F P30939 1/20 0.41
HTR7 P34969 1/20 0.41
DRD3 P35462 1/20 0.41
HTR6 P50406 1/20 0.41
NPC1 O15118 1/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41

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
SCHEMBL8545409 0.88 MAPT (0.44) MEN1KMT2ATMEM97SIGMAR1MAPT
SCHEMBL8542950 0.87 DRD2 (0.47) ALOX15MEN1KMT2AKDM4ERAB9A
SCHEMBL8542208 0.82 ALOX15 (0.48) ALOX15KDM4ERAB9AHTR1ADRD2
SCHEMBL8541772 0.82 ELANE (0.46) ALOX15MEN1KMT2APOLBKDM4E
SCHEMBL19831095 0.81 ALOX15 (0.53) ALOX15TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL8540260 0.80 MAPT (0.48) ALOX15KDM4EMAPTALDH1A1HPGD
SCHEMBL8546244 0.79 MAPT (0.47) ALOX15KDM4ERAB9AMAPTALDH1A1
SCHEMBL8542731 0.78 ALOX15 (0.41) ALOX15MEN1KMT2APOLBALDH1A1
SCHEMBL8795255 0.76 ALOX15 (0.57) ALOX15MAPT
SCHEMBL8540507 0.75 KDM4E (0.60) ALOX15MEN1KMT2APOLBKDM4E

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-0483881-B1 3-Amidoindolyl derivatives MERRELL PHARMA INC (US) 1998-01-21 EP disclosed
US-5703107-A CENTRAL NERVOUS SYSTEM DISORDERS; ANALGESICS; ANTIEPILEPTIC AGENTS MERRELL PHARMACEUTICALS INC. (US) 1997-12-30 US disclosed
US-5675018-A 3-amidoindolyl derivatives MERRELL PHARMACEUTICALS INC. (US) 1997-10-07 US disclosed
US-5491153-A 3-amidoindolyl derivative MERRELL DOW PHARMACEUTICALS INC. (US) 1996-02-13 US disclosed
US-5189054-A 3-amidoindolyl derivatives and pharmaceutical compositions thereof MERRELL DOW PHARMACEUTICALS INC. (US) 1993-02-23 US disclosed
EP-0483881-A1 3-Amidoindolyl derivatives MERRELL PHARMACEUTICALS INC. (US) 1992-05-06 EP disclosed