SCHEMBL22010374

SCHEMBL22010374

CCc1nccc(-c2ccc(F)c(CC)c2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 6/20 0.44
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
KDM4E B2RXH2 2/20 0.38
POLB P06746 2/20 0.38
ALDH1A1 P00352 1/20 0.38
TRPV3 Q8NET8 1/20 0.38
MAPK1 P28482 2/20 0.37
MAPT P10636 2/20 0.35
HPGD P15428 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
AAK1 Q2M2I8 2/20 0.34
CDK4 P11802 1/20 0.34
CDK2 P24941 1/20 0.34
PIK3CA P42336 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL12844279 0.77 KMO (0.55) KMOKDM4EMAPTCDK2MEN1
SCHEMBL14526063 0.76 MAPT (0.51) KMOKDM4EALDH1A1MAPTCDK2
SCHEMBL17826991 0.74 KMO (0.55) KMOMAPTMAP4K4
SCHEMBL10490481 0.74 MEN1 (0.53) KDM4EPOLBALDH1A1TRPV3MAPT
SCHEMBL21087455 0.74 DHFR (0.39)
SCHEMBL10272516 0.72 AURKA (0.53) KDM4EPOLBALDH1A1MAPK1MAPT
SCHEMBL16526773 0.72 ASIC3 (0.42) MAPKAPK2MAPKAPK3MAP4K4
SCHEMBL16629561 0.71 KMO (0.58) KMOKDM4EALDH1A1TRPV3CDK2
SCHEMBL2759537 0.70 HSP90AA1 (0.58) KDM4EALDH1A1HPGD
SCHEMBL10490263 0.70 TRPV3 (0.37) KDM4EPOLBALDH1A1TRPV3MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10662189-B2 PDE4 inhibitor Shijiazhuang Sagacity New Drug Development Co., Ltd. (CN) 2020-05-26 US 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 (1 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-10662189-B2 PDE4 inhibitor PDE4A, PDE12, PDE4B KMO 3379/4885ESR1 4661/4885ESR2 3851/4885

“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.