SCHEMBL23629331

SCHEMBL23629331

CC[S+]([O-])c1cc(Br)cnc1-c1cn(-c2ccc(OC(F)(F)F)cc2)cn1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 5/20 0.34
GRIN1 Q05586 5/20 0.34
GRIN2B Q13224 5/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
NLRP3 Q96P20 1/20 0.33
ABL1 P00519 1/20 0.33
BCR P11274 1/20 0.33
SCN5A Q14524 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP19A1 P11511 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
CACNA2D1 P54289 1/20 0.32
TLR2 O60603 1/20 0.32
TLR1 Q15399 1/20 0.32
CXCR2 P25025 5/20 0.32
PTGS2 P35354 1/20 0.30

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
SCHEMBL23629308 0.79 DDR1 (0.42) RXRAGRIN1GRIN2BNPC1RAB9A
SCHEMBL21727242 0.68 NPC1 (0.30) NPC1RAB9A
SCHEMBL1229624 0.68 SCN5A (0.40) RXRAGRIN1GRIN2BNPC1RAB9A
SCHEMBL23629300 0.67 PDE2A (0.36) RXRAGRIN1GRIN2B
SCHEMBL24261740 0.67
SCHEMBL22199017 0.65 CYP1A2 (0.59) RXRAGRIN1GRIN2BNPC1RAB9A
SCHEMBL29559751 0.65 MAPT (0.48) NPC1RAB9ANLRP3SCN5ACYP3A4
SCHEMBL1259307 0.65 MAPT (0.47) NPC1RAB9ANLRP3SCN5ACYP1A2
SCHEMBL27843249 0.64 PPARD (0.35) RXRAGRIN1GRIN2BCYP3A4CYP2C9
SCHEMBL20588626 0.63 SCN5A (0.40) RXRAGRIN1GRIN2BSCN5ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3848362-B1 HETEROARYL AZOLE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO (JP) 2025-10-29 EP disclosed
US-12180178-B2 Heteroaryl azole compound and pest control agent NIPPON SODA CO., LTD. (JP) 2024-12-31 US disclosed
EP-4455135-A2 HETEROARYL AZOLE COMPOUND AND PEST CONTROL AGENT Nippon Soda Co., Ltd. (JP) 2024-10-30 EP disclosed
US-20240327377-A1 HETEROARYL AZOLE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2024-10-03 US disclosed
EP-3848362-A1 HETEROARYL AZOLE COMPOUND AND PEST CONTROL AGENT Nippon Soda Co., Ltd. (JP) 2021-07-14 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 (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-20240327377-A1 HETEROARYL AZOLE COMPOUND AND PEST CONTROL AGENT INF2, CRY2, CRY1 RXRA 3386/4885GRIN1 3513/4885GRIN2B 2631/4885
US-12180178-B2 Heteroaryl azole compound and pest control agent CRY1, CRY2, H1-2 RXRA 2271/4885GRIN1 2675/4885GRIN2B 2225/4885

“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.