SCHEMBL10397362

SCHEMBL10397362

NC([C]=O)Cc1cc(Br)c(O)c(Br)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.37
TSHR P16473 3/20 0.37
CYP3A4 P08684 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
THRA P10827 1/20 0.36
THRB P10828 1/20 0.36
PPARG P37231 1/20 0.36
TTR P02766 2/20 0.35
MEN1 O00255 1/20 0.35
ALB P02768 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 3/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2D6 P10635 1/20 0.33
HIF1A Q16665 2/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
ALOX12 P18054 1/20 0.31
CASP1 P29466 1/20 0.31

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
SCHEMBL10397363 1.00 PTPN1 (0.37) PTPN1TSHRCYP3A4TDP1THRA
SCHEMBL6041026 0.78 SIRT5 (0.50) TSHRCYP3A4THRATHRBPPARG
SCHEMBL6041028 0.78 SIRT5 (0.50) TSHRCYP3A4THRATHRBPPARG
Dibromotyrosine SCHEMBL838919 0.74 THRB (0.58) PTPN1CYP3A4TDP1THRATHRB
Dibromotyrosine SCHEMBL145218 0.74 THRB (0.58) PTPN1CYP3A4TDP1THRATHRB
SCHEMBL10397364 0.74 PTPN1 (0.37) PTPN1TSHRCYP3A4TDP1THRA
Dibromotyrosine SCHEMBL145219 0.74 THRB (0.58) PTPN1CYP3A4TDP1THRATHRB
Dibromotyrosine SCHEMBL29399010 0.73 THRB (0.57) CYP3A4TDP1THRATHRBPPARG
SCHEMBL17559228 0.71 IDO1 (0.39)
SCHEMBL17559229 0.71 IDO1 (0.39)

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-4948873-A SEX HORMONE REGULATORS RICHTER GEDEON VEGYESZETI GYAR (HU) 1990-08-14 US claimed
EP-0220654-A2 Gonadoliberine analogues, process for preparing them, pharmaceutical composition and use RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1987-05-06 EP claimed
US-4948873-A SEX HORMONE REGULATORS RICHTER GEDEON VEGYESZETI GYAR (HU) 1990-08-14 US disclosed
US-4948873-A SEX HORMONE REGULATORS RICHTER GEDEON VEGYESZETI GYAR (HU) 1990-08-14 US disclosed
EP-0220654-A3 GONADOLIBERINE ANALOGUES, PROCESS FOR PREPARING THEM, PHARMACEUTICAL COMPOSITION AND USE RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1989-09-06 EP disclosed
EP-0220654-A2 Gonadoliberine analogues, process for preparing them, pharmaceutical composition and use RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1987-05-06 EP disclosed
EP-0220654-A2 Gonadoliberine analogues, process for preparing them, pharmaceutical composition and use RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1987-05-06 EP disclosed