SCHEMBL29525907

SCHEMBL29525907

NNc1ccc(C(F)(F)F)cn1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.53
RAB9A P51151 7/20 0.49
NPC1 O15118 5/20 0.49
KMT2A Q03164 4/20 0.47
GAA P10253 3/20 0.46
MEN1 O00255 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
CDK5 Q00535 3/20 0.46
CDK5R1 Q15078 3/20 0.46
MAPT P10636 2/20 0.46
GFER P55789 1/20 0.46
ALDH1A1 P00352 2/20 0.45
POLB P06746 2/20 0.45
LMNA P02545 1/20 0.45
XPO1 O14980 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
RPS6KA3 P51812 1/20 0.43
DEGS1 O15121 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL587272 1.00 PTGS1 (0.53) PTGS1RAB9ANPC1KMT2AGAA
Hydrochloric Acid SCHEMBL15167588 0.98 PTGS1 (0.51) PTGS1RAB9ANPC1KMT2AGAA
Hydrochloric Acid SCHEMBL30062287 0.98 PTGS1 (0.51) PTGS1RAB9ANPC1KMT2AGAA
SCHEMBL8989471 0.83 RAB9A (0.51) PTGS1RAB9ANPC1KMT2AGAA
SCHEMBL16343351 0.81 CSF1R (0.44) PTGS1RAB9ANPC1DEGS1
SCHEMBL16343658 0.81 PTGS1 (0.44) PTGS1RAB9ANPC1KMT2AGAA
SCHEMBL16343659 0.81 PTGS1 (0.44) PTGS1RAB9ANPC1KMT2AGAA
SCHEMBL16343747 0.81 TAAR1 (0.49) PTGS1DEGS1
Ethoxycarbonyl Group SCHEMBL28282913 0.81 GAA (0.51) PTGS1RAB9ANPC1KMT2AGAA
SCHEMBL116298 0.79 RAB9A (0.49) PTGS1RAB9ANPC1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3983411-B1 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS PEST CONTROL AGENTS PI INDUSTRIES LTD (IN) 2026-05-27 EP disclosed
US-12384787-B2 Fused heterocyclic compounds and their use as pest control agents PI INDUSTRIES LTD (IN) 2025-08-12 US disclosed
CN-115605467-B PHD inhibitor compounds, compositions and uses thereof 阿克比治疗有限公司 2025-06-13 CN disclosed
CN-120004851-A PHD inhibitor compounds, compositions and uses thereof 阿克比治疗有限公司 2025-05-16 CN disclosed
CN-119552120-A Pyrazole and imidazole compounds for inhibiting IL-17 and rory 里亚塔医药公司 2025-03-04 CN disclosed
CN-112654610-B Pyrazole and imidazole compounds for inhibiting IL-17 and rory 里亚塔医药公司 2024-12-24 CN disclosed
CN-119156379-A Novel pyrazole derivatives 阿普塔生物治疗公司 2024-12-17 CN disclosed
CN-119113123-A Method for treating or preventing diabetes mellitus by using combination drug 日本烟草产业株式会社 2024-12-13 CN disclosed
CN-114585387-B Method for treating or preventing diabetes mellitus by using combination drug 日本烟草产业株式会社 2024-10-29 CN disclosed
CN-114641314-B Method for treating or preventing chronic kidney disease 日本烟草产业株式会社 2024-05-28 CN disclosed
CN-111770923-B Heterocyclic compound and harmful arthropod control agent containing same 住友化学株式会社 2024-04-09 CN disclosed
CN-116583287-A Pyridazinone heterocyclic compound, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2023-08-11 CN disclosed
CN-115916766-A Novel pyrazole derivatives 阿普塔生物治疗公司 2023-04-04 CN disclosed
CN-115605467-A PHD inhibitor compounds, compositions and uses thereof 阿克比治疗有限公司(US) 2023-01-13 CN disclosed
CN-113747783-B Heterocyclic compound and harmful arthropod control composition containing same 住友化学株式会社 2022-10-11 CN disclosed
CN-114945561-A Novel pyrazole derivatives 阿普塔生物治疗公司 2022-08-26 CN disclosed
US-20220251094-A1 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS PEST CONTROL AGENTS PI INDUSTRIES LTD. (IN) 2022-08-11 US disclosed
EP-3983411-A1 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS PEST CONTROL AGENTS PI Industries Ltd. (IN) 2022-04-20 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-12384787-B2 Fused heterocyclic compounds and their use as pest control agents DDT, ACHE, KEAP1 PTGS1 1070/4885RAB9A 29/4885NPC1 3338/4885
US-20220251094-A1 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS PEST CONTROL AGENTS DDT, ACHE, KEAP1 PTGS1 1070/4885RAB9A 29/4885NPC1 3338/4885

“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.