Fluoride

Fluoride

SCHEMBL3304552

F.F.c1ccc([PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
TSHR P16473 5/20 0.33
TDP1 Q9NUW8 5/20 0.33
ALOX12 P18054 3/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
CA12 O43570 1/20 0.33
GLA P06280 1/20 0.33
CA3 P07451 1/20 0.33
CA4 P22748 1/20 0.33
CA14 Q9ULX7 1/20 0.33
LMNA P02545 1/20 0.33
ACHE P22303 1/20 0.33
CA7 P43166 1/20 0.33
HSD17B10 Q99714 3/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MGLL Q99685 1/20 0.32

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
Fluoride SCHEMBL7906437 1.00 ALDH1A1 (0.38) ALDH1A1TSHRTDP1ALOX12CA1
Fluoride SCHEMBL18936426 1.00 ALDH1A1 (0.38) ALDH1A1TSHRTDP1ALOX12CA1
Benzene SCHEMBL28207368 0.96 ALDH1A1 (0.40) ALDH1A1TSHRTDP1ALOX12CA1
SCHEMBL28748541 0.96 ALDH1A1 (0.40) ALDH1A1TSHRTDP1ALOX12CA1
SCHEMBL26674 0.96 ALDH1A1 (0.40) ALDH1A1TSHRTDP1ALOX12CA1
Hydrochloric Acid SCHEMBL8028044 0.92 ALDH1A1 (0.38) ALDH1A1TSHRTDP1ALOX12CA1
Water SCHEMBL18039121 0.92 ALDH1A1 (0.38) ALDH1A1TSHRTDP1ALOX12CA1
SCHEMBL9302217 0.92 ALDH1A1 (0.38) ALDH1A1TSHRTDP1ALOX12CA1
SCHEMBL9068833 0.92 ALDH1A1 (0.38) ALDH1A1TSHRTDP1ALOX12CA1
Phosphine SCHEMBL20701190 0.92 ALDH1A1 (0.38) ALDH1A1TSHRTDP1ALOX12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4780559-A Process for preparing organic fluorides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-10-25 US claimed
US-20100096585-A1 Process for Preparing 2,6-Dichloro-4-(Trifluoromethyl)Phenylhydrazine Using Mixtures of Dichloro-Fluoro-Trifluoromethylbenzenes BASF SE (DE) 2010-04-22 US disclosed
EP-2137135-A1 PROCESS FOR PREPARING 2,6-DICHLORO-4-(TRIFLUOROMETHYL)PHENYLHYDRAZINE USING MIXTURES OF DICHLORO-FLUORO-TRIFLUOROMETHYLBENZENES BASF SE (DE) 2009-12-30 EP disclosed
WO-2008113660-A1 PROCESS FOR PREPARING 2,6-DICHLORO-4-(TRIFLUOROMETHYL)PHENYLHYDRAZINE USING MIXTURES OF DICHLORO-FLUORO-TRIFLUOROMETHYLBENZENES BASF SE (DE) 2008-09-25 WO disclosed
EP-0413464-A2 Catalysts IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-02-20 EP disclosed
EP-0413465-A2 Catalysts IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-02-20 EP disclosed
US-4956428-A POLYMERIZATION OF ACRYLIC OR MALEIMIDE MONOMER WITH ORGANOSILICON, ORGANOTIN, ORGANOGERMANIUM INITIATORS, COORDINATION CATALYST IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-09-11 US disclosed
EP-0329330-A2 Polymerisation process IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1989-08-23 EP disclosed
EP-0329329-A2 Polymerisation process IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1989-08-23 EP disclosed
US-4791181-A LOW CONCENTRATIONS OF ACETONITRILE USED TO CONTROL FORMATION OF LIVING POLYMERS BY BULK POLYMERIZATION IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-12-13 US disclosed
US-4780559-A Process for preparing organic fluorides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-10-25 US disclosed
EP-0278668-A2 Polymerisation process IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-08-17 EP disclosed
EP-0187023-A2 Process for the preparation of organic fluorides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-07-09 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100096585-A1 Process for Preparing 2,6-Dichloro-4-(Trifluoromethyl)Phenylhydrazine Using Mixtures of Dichloro-Fluoro-Trifluoromethylbenzenes DAZAP1, CYP4Z1, CYP2F1 ALDH1A1 93/4885TSHR 2956/4885TDP1 2648/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.