SCHEMBL22265802

SCHEMBL22265802

N=C(NO)N1CCC(Cc2ccc(F)c(F)c2)CC1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
MAPK14 Q16539 1/20 0.40
CNR1 P21554 3/20 0.39
KMT2A Q03164 2/20 0.39
SCN9A Q15858 1/20 0.39
CCR3 P51677 1/20 0.38
ALDH1A1 P00352 1/20 0.37
HTT P42858 1/20 0.37
MGLL Q99685 1/20 0.37
MEN1 O00255 1/20 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
SCHEMBL22265887 0.83 F2 (0.49) CYP2C9CYP2C19MAPK14KMT2AMGLL
SCHEMBL22266015 0.82 CCR3 (0.43) CYP2C9CYP2C19MAPK14KMT2ACCR3
SCHEMBL28687942 0.80 ALDH1A1 (0.53) CYP2C9CYP2C19MAPK14KMT2ACCR3
SCHEMBL22265976 0.79 CCR3 (0.43) CYP2C9CYP2C19MAPK14KMT2ACCR3
SCHEMBL23365206 0.79 CYP2C9 (0.52) CYP2C9CYP2C19MAPK14KMT2ACCR3
SCHEMBL22265641 0.79 MGLL (0.59) KMT2ACCR3MGLLMEN1
SCHEMBL22265834 0.78 CYP2C9 (0.48) CYP2C9CYP2C19MAPK14SCN9ACCR3
SCHEMBL22265804 0.76 CYP2C9 (0.40) CYP2C9CYP2C19MAPK14CNR1SCN9A
SCHEMBL4292162 0.75 CNR1 (0.52) CNR1KMT2AALDH1A1HTTMEN1
SCHEMBL16312205 0.75 CNR1 (0.48) CNR1SCN9AALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12268687-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2025-04-08 US disclosed
US-20250034124-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2025-01-30 US disclosed
US-20250034125-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2025-01-30 US disclosed
US-12098146-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-09-24 US disclosed
US-20230116101-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. 2023-04-13 US disclosed
CN-113906019-A Compound and use thereof 优曼尼蒂治疗公司 2022-01-07 CN disclosed
EP-3914593-A1 COMPOUNDS AND USES THEREOF Yumanity Therapeutics, Inc. (US) 2021-12-01 EP disclosed
WO-2021097240-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2021-05-20 WO disclosed
WO-2021097240-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2021-05-20 WO disclosed
US-20210139471-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2021-05-13 US disclosed
US-20210139471-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2021-05-13 US disclosed
WO-2020154571-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-07-30 WO disclosed
WO-2020154571-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-07-30 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 (6 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-20250034124-A1 COMPOUNDS AND USES THEREOF NLN, BDNF, NQO1 CYP2C9 2172/4885CYP2C19 2187/4885MAPK14 3699/4885
US-12268687-B2 Compounds and uses thereof NLN, BDNF, NQO1 CYP2C9 2172/4885CYP2C19 2187/4885MAPK14 3699/4885
US-20230116101-A1 COMPOUNDS AND USES THEREOF NLN, BDNF, NQO1 CYP2C9 2172/4885CYP2C19 2187/4885MAPK14 3699/4885
US-20250034125-A1 COMPOUNDS AND USES THEREOF NLN, BDNF, NQO1 CYP2C9 2172/4885CYP2C19 2187/4885MAPK14 3699/4885
US-20210139471-A1 COMPOUNDS AND USES THEREOF NLN, BDNF, NQO1 CYP2C9 2172/4885CYP2C19 2187/4885MAPK14 3699/4885
US-12098146-B2 Compounds and uses thereof NLN, BDNF, NQO1 CYP2C9 2172/4885CYP2C19 2187/4885MAPK14 3699/4885

“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.