SCHEMBL11307755

SCHEMBL11307755

O=P(O)(O)Cc1c(Cl)cccc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 1.00
▸ PGK1 P00558 3/20 0.48
▸ PGK2 P07205 3/20 0.48
▸ AKR1B1 P15121 1/20 0.48
▸ ACP3 P15309 3/20 0.42
▸ TAAR1 Q96RJ0 1/20 0.41
▸ ADRA2A P08913 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ HTR1A P08908 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ ADRA2B P18089 1/20 0.40
▸ ADRA2C P18825 1/20 0.40
▸ MAOA P21397 1/20 0.40
▸ ADRA1D P25100 1/20 0.40
▸ HTR2A P28223 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
SCHEMBL11772582 0.77 SMN1; SMN2 (0.62) SMN1; SMN2PGK1PGK2ACP3TAAR1
SCHEMBL8824613 0.76 SMN1; SMN2 (0.61) SMN1; SMN2PGK1PGK2ACP3TAAR1
SCHEMBL578080 0.73 SMN1; SMN2 (0.57) SMN1; SMN2PGK1PGK2ACP3POLB
SCHEMBL27204345 0.72 SMN1; SMN2 (0.57) SMN1; SMN2AKR1B1TAAR1POLBNPSR1
SCHEMBL9168205 0.72 SMN1; SMN2 (0.56) SMN1; SMN2PGK1PGK2ACP3MAPK1
SCHEMBL3421056 0.71 SMN1; SMN2 (0.56) SMN1; SMN2PGK1PGK2ACP3MEN1
SCHEMBL10882371 0.71 SMN1; SMN2 (0.55) SMN1; SMN2AKR1B1
SCHEMBL11121515 0.71 PGK1 (0.52) SMN1; SMN2PGK1PGK2ACP3MAPK1
SCHEMBL5250114 0.70 SMN1; SMN2 (0.53) SMN1; SMN2AKR1B1TAAR1POLBNPSR1
1,2-Dichlorobenzene SCHEMBL27820436 0.69 LMNA (0.62) SMN1; SMN2ACP3POLBLMNACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4299615-A PLANT GROWTH REGULATOR VELSICOL CHEMICAL CORPORATION (US) 1981-11-10 — — US claimed
US-4299615-A PLANT GROWTH REGULATOR VELSICOL CHEMICAL CORPORATION (US) 1981-11-10 — — US disclosed
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