SCHEMBL18964856

SCHEMBL18964856

OBc1ccc(F)c(C(F)(F)F)c1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MPL P40238 3/20 0.37
▸ AR P10275 5/20 0.36
▸ KMO O15229 2/20 0.36
▸ KIF11 P52732 1/20 0.36
▸ PTPN7 P35236 3/20 0.36
▸ DUSP3 P51452 3/20 0.36
▸ GRM4 Q14833 1/20 0.36
▸ SLC22A12 Q96S37 1/20 0.35
▸ TAS1R3 Q7RTX0 2/20 0.35
▸ TAS1R1 Q7RTX1 2/20 0.35
▸ TAS1R2 Q8TE23 2/20 0.35
▸ NOTUM Q6P988 1/20 0.35

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
SCHEMBL18964945 0.78 HTR3E (0.47) GRM4NOTUM
SCHEMBL10187271 0.75 CES2 (0.41) —
SCHEMBL19523877 0.73 AR (0.56) AR
SCHEMBL30977609 0.71 KIF11 (0.53) MPLARKMOKIF11PTPN7
SCHEMBL156681 0.71 KIF11 (0.53) MPLARKMOKIF11PTPN7
SCHEMBL19886480 0.71 HTR2A (0.40) MPLARKMOKIF11PTPN7
SCHEMBL7265211 0.70 IDO1 (0.48) MPLARKIF11SLC22A12
SCHEMBL31030963 0.70 MPL (0.55) MPLARKMOKIF11
SCHEMBL29775945 0.70 IDO1 (0.48) MPLARKIF11SLC22A12
SCHEMBL13390477 0.70 RXRA (0.50) AR

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-20230023543-A1 HETEROAROMATIC NMDA RECEPTOR MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2023-01-26 — — US disclosed
US-10626122-B2 Heteroaromatic NMDA receptor modulators and uses thereof CADENT THERAPEUTICS, INC. (US) 2020-04-21 — — US disclosed
WO-2017100591-A1 HETEROAROMATIC NMDA RECEPTOR MODULATORS AND USES THEREOF LUC THERAPEUTICS (US) 2017-06-15 — — 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 (2 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-10626122-B2 Heteroaromatic NMDA receptor modulators and uses thereof GRIN2C, GRIN2A, GRIN1 MPL 3471/4885AR 530/4885KMO 194/4885
US-20230023543-A1 HETEROAROMATIC NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN2C, GRIN2A, GRIN1 MPL 3471/4885AR 530/4885KMO 194/4885

“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.

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