SCHEMBL23925083

SCHEMBL23925083

O=[N+]([O-])c1cnc2c(OC(F)(F)F)cccc2c1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 7/20 0.45
GAA P10253 1/20 0.43
KMT2A Q03164 4/20 0.42
TDP1 Q9NUW8 4/20 0.42
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 3/20 0.42
MEN1 O00255 3/20 0.42
POLB P06746 1/20 0.39
HTT P42858 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
LMNA P02545 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HPGD P15428 1/20 0.38
ATM Q13315 1/20 0.38
TNF P01375 1/20 0.38
LITAF Q99732 1/20 0.38
PRKCQ Q04759 1/20 0.37
MAPT P10636 3/20 0.36
PKM P14618 2/20 0.36

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
SCHEMBL29989486 1.00 PIN1 (0.45) PIN1GAAKMT2ATDP1ALDH1A1
SCHEMBL28926222 0.82 PIN1 (0.53) PIN1GAAKMT2ATDP1ALDH1A1
SCHEMBL29233306 0.81 PIN1 (0.40) PIN1GAAKMT2ATDP1ALDH1A1
SCHEMBL10040154 0.77 ALDH1A1 (0.48) PIN1KMT2ATDP1ALDH1A1KDM4E
SCHEMBL4723755 0.77 PIN1 (0.55) PIN1GAAKMT2AMEN1POLB
SCHEMBL22118228 0.75 ALDH1A1 (0.48) PIN1GAAKMT2ATDP1ALDH1A1
SCHEMBL437559 0.72 HAVCR2 (0.40) KMT2AKDM4EHPGDTNFLITAF
SCHEMBL4775390 0.71 ALDH1A1 (0.50) PIN1KMT2ATDP1ALDH1A1KDM4E
SCHEMBL14744388 0.71 HPGD (0.44) TDP1ALDH1A1POLBHTTSMN1; SMN2
SCHEMBL23497102 0.71 PDE4A (0.42) KMT2AALDH1A1KDM4EMEN1SMN1; 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12134616-B2 Tricyclic pesticidal compounds BASF SE (DE) 2024-11-05 US disclosed
CN-112867714-B Pesticidal tricyclic compounds 巴斯夫欧洲公司 2024-06-11 CN disclosed
EP-3870581-B1 TRICYCLIC PESTICIDAL COMPOUNDS BASF SE (DE) 2023-06-14 EP disclosed
US-20230141433-A1 TRICYCLIC PESTICIDAL COMPOUNDS BASF CHEMICALS INDIA PVT. LTD. (IN) 2023-05-11 US disclosed
EP-4136086-A1 TRICYCLIC PESTICIDAL COMPOUNDS BASF SE (DE) 2023-02-22 EP disclosed
CN-115427408-A Pesticidal tricyclic compounds 巴斯夫欧洲公司 2022-12-02 CN disclosed
US-20210347777-A1 TRICYCLIC PESTICIDAL COMPOUNDS BASF SE (DE) 2021-11-11 US disclosed
WO-2021209265-A1 TRICYCLIC PESTICIDAL COMPOUNDS BASF SE (DE) 2021-10-21 WO disclosed
CN-112867714-A Pesticidal tricyclic compounds 巴斯夫欧洲公司 2021-05-28 CN 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 (3 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-20210347777-A1 TRICYCLIC PESTICIDAL COMPOUNDS DDT, ACHE, PFAS PIN1 425/4885GAA 1779/4885KMT2A 3249/4885
US-20230141433-A1 TRICYCLIC PESTICIDAL COMPOUNDS DDT, ACHE, PFAS PIN1 425/4885GAA 1779/4885KMT2A 3249/4885
US-12134616-B2 Tricyclic pesticidal compounds DDT, ACHE, PFAS PIN1 425/4885GAA 1779/4885KMT2A 3249/4885

“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.