Phosphoric Acid

Phosphoric Acid

SCHEMBL7866355

CCN1CC=C(c2cc3cccc(NC=O)c3[nH]2)CC1.O=P(O)(O)O

nearest known ligand 0.38

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Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Phosphoric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 10/20 0.38
CDK9 P50750 10/20 0.38
HTR1F P30939 2/20 0.37
HTR1A P08908 3/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
ALOX15 P16050 1/20 0.35
HTR6 P50406 2/20 0.34
BTK Q06187 1/20 0.34

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
Phosphoric Acid SCHEMBL7859763 0.81 HTR1F (0.42) CCNT1CDK9HTR1FKDM4ELMNA
Phosphoric Acid SCHEMBL7870823 0.80 HTR1F (0.39) CCNT1CDK9HTR1FKDM4ELMNA
SCHEMBL6028314 0.79 KDM4E (0.45) CCNT1CDK9HTR1FKDM4ELMNA
Phosphoric Acid SCHEMBL7867410 0.79 HTR1F (0.35) HTR1FHTR1AKDM4ELMNAALOX15
Phosphoric Acid SCHEMBL7866421 0.79 KDM4E (0.53) HTR1FHTR1AKDM4ELMNAALOX15
SCHEMBL7866361 0.77 KDM4E (0.37) CCNT1CDK9HTR1FKDM4ELMNA
Phosphoric Acid SCHEMBL7859801 0.76 KDM4E (0.35) CCNT1CDK9HTR1FKDM4ELMNA
Phosphoric Acid SCHEMBL7870844 0.75 KDM4E (0.34) CCNT1CDK9HTR1FKDM4EBTK
Phosphoric Acid SCHEMBL7870918 0.75 KDM4E (0.53) HTR1FHTR1AKDM4ELMNAALOX15
Oxalic Acid SCHEMBL7867409 0.74 KMT2A (0.42) CCNT1CDK9HTR1FKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1077213-A2 Inhibition of serotonin reuptake ELI LILLY AND COMPANY (US) 2001-02-21 EP disclosed
US-6046215-A A PIPERIDINYLBENZOTHIOPHENES USEFUL FOR TRATING BRAIN DISORDERS ELI LILLY AND COMPANY (US) 2000-04-04 US disclosed
US-5846982-A Inhibition of serotonin reuptake ELI LILLY AND COMPANY (US) 1998-12-08 US disclosed
EP-0812826-A1 1H-indole and benzo(b)thiophene derivatives with 4-(1,2,3,6-tetra:hydro:pyridinyl)- and 4-piperidinyl-groups bound to the heterocyclic ring as inhibitors of serotonin reuptake ELI LILLY AND COMPANY (US) 1997-12-17 EP disclosed