SCHEMBL8417547

SCHEMBL8417547

O=C(c1cccc(Cl)c1Cl)P(=O)(c1ccccc1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.56
ERCC5 P28715 1/20 0.46
FEN1 P39748 1/20 0.46
ALDH1A1 P00352 1/20 0.46
P2RX7 Q99572 2/20 0.45
TMEM97 Q5BJF2 2/20 0.44
SIGMAR1 Q99720 2/20 0.44
POLB P06746 1/20 0.43
JAK2 O60674 1/20 0.43
MAOB P27338 1/20 0.43
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
TAS1R2 Q8TE23 1/20 0.43
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
SMO Q99835 2/20 0.41
GPR139 Q6DWJ6 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MEN1 O00255 1/20 0.40

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
SCHEMBL20135648 0.86 GPR27 (0.45) TSHRALDH1A1POLBCES2CES1
SCHEMBL17023658 0.81 CA2 (0.48) TSHRALDH1A1NPC1RAB9AMEN1
SCHEMBL67557 0.80 ALDH1A1 (0.47) TSHRFEN1ALDH1A1POLBJAK2
SCHEMBL2940225 0.75 SMN1; SMN2 (0.55) TSHRERCC5FEN1ALDH1A1TMEM97
SCHEMBL28788708 0.74 TERT (0.45) TSHRALDH1A1POLBNPC1RAB9A
SCHEMBL68477 0.74 NR4A1 (0.58) ALDH1A1POLBNPC1RAB9AMEN1
SCHEMBL97298 0.73 TSHR (1.00) TSHRERCC5FEN1ALDH1A1P2RX7
SCHEMBL29904615 0.73 TSHR (1.00) TSHRERCC5FEN1ALDH1A1P2RX7
SCHEMBL57823 0.73 HPGD (0.50) TSHRERCC5FEN1ALDH1A1POLB
SCHEMBL19253581 0.73 MAPT (0.55) TSHRALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4778831-A Sealing compounds, the preparation thereof, and use of same KUNSTSTOFF- & LACKFABRIK KEMPER (DE) 1988-10-18 US claimed
EP-0722993-B1 Process for coating a steel plate DAINIPPON TORYO KK (JP) 1999-09-08 EP disclosed
EP-0722993-A1 Process for coating a steel plate Dai Nippon Toryo Co., Ltd. (JP) 1996-07-24 EP disclosed