SCHEMBL17099766

SCHEMBL17099766

FC(F)C(F)Oc1cccc(-c2ccccn2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ PRMT5 O14744 1/20 0.41
▸ WDR77 Q9BQA1 1/20 0.41
▸ FFAR1 O14842 1/20 0.41
▸ CYP2A6 P11509 1/20 0.40
▸ TGFBR1 P36897 1/20 0.40
▸ GRM4 Q14833 1/20 0.40
▸ MAP4K4 O95819 1/20 0.40
▸ HTR1A P08908 1/20 0.40
▸ HTR7 P34969 1/20 0.40
▸ LMNA P02545 3/20 0.39
▸ HPGD P15428 2/20 0.39
▸ CETP P11597 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ MEN1 O00255 1/20 0.39

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
SCHEMBL22954280 0.88 GRM4 (0.51) GRM5NPC1PKMRAB9ASMN1; SMN2
SCHEMBL30117418 0.88 GRM4 (0.51) GRM5NPC1PKMRAB9ASMN1; SMN2
SCHEMBL5959942 0.82 GRM5 (0.69) GRM5NPC1PKMRAB9ASMN1; SMN2
SCHEMBL8252632 0.81 GABRA1 (0.54) GRM5NPC1PKMRAB9ASMN1; SMN2
SCHEMBL31187765 0.79 GRM5 (0.49) GRM5NPC1PKMRAB9ASMN1; SMN2
SCHEMBL17500184 0.79 GRM5 (0.49) GRM5NPC1PKMRAB9ASMN1; SMN2
SCHEMBL23526602 0.77 GRM5 (0.48) GRM5NPC1PKMRAB9ASMN1; SMN2
SCHEMBL31083655 0.77 GRM5 (0.48) GRM5NPC1PKMRAB9ASMN1; SMN2
SCHEMBL183897 0.76 DYRK1A (0.66) GRM5NPC1PKMRAB9ASMN1; SMN2
SCHEMBL29496945 0.76 DYRK1A (0.66) GRM5NPC1PKMRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10745378-B2 Antifungal compound process Mycovia Pharmaceuticals, Inc. (US) 2020-08-18 — — US disclosed
US-20190161470-A1 Antifungal Compound Process MYCOVIA PHARMACEUTICALS INC (US) 2019-05-30 — — US disclosed
US-10196375-B2 Antifungal compound process Mycovia Pharmaceuticals, Inc. (US) 2019-02-05 — — US disclosed
US-20170081310-A1 ANTIFUNGAL COMPOUND PROCESS Mycovia Pharmaceuticals, Inc. 2017-03-23 — — US disclosed
EP-3119754-A1 ANTIFUNGAL COMPOUND PROCESS Viamet Pharmaceuticals, Inc. (US) 2017-01-25 — — EP disclosed
WO-2015143142-A1 ANTIFUNGAL COMPOUND PROCESS VIAMET PHARMACEUTICALS, INC. (US) 2015-09-24 — — WO 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 (4 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-10745378-B2 Antifungal compound process ERG28, DPM1, CYP51A1 GRM5 3618/4885NPC1 29/4885PKM 2421/4885
US-20170081310-A1 ANTIFUNGAL COMPOUND PROCESS ERG28, DPM1, CYP51A1 GRM5 3618/4885NPC1 29/4885PKM 2421/4885
US-20190161470-A1 Antifungal Compound Process ERG28, DPM1, CYP51A1 GRM5 3618/4885NPC1 29/4885PKM 2421/4885
US-10196375-B2 Antifungal compound process ERG28, DPM1, CYP51A1 GRM5 3618/4885NPC1 29/4885PKM 2421/4885

“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.

Send feedback