SCHEMBL4897397

SCHEMBL4897397

CCCCC(CC)CNCCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
KDM4E B2RXH2 1/20 0.58
SIGMAR1 Q99720 8/20 0.58
CYP3A4 P08684 1/20 0.55
TSHR P16473 1/20 0.55
KCNH2 Q12809 1/20 0.46
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
ANPEP P15144 1/20 0.43
ERAP2 Q6P179 1/20 0.43
ADRB2 P07550 2/20 0.42
ATM Q13315 1/20 0.42
TAAR1 Q96RJ0 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
SCHEMBL15823338 0.86 ALDH1A1 (0.50) ALDH1A1KDM4ESIGMAR1CYP3A4TSHR
Hydrochloric Acid SCHEMBL3374245 0.86 SIGMAR1 (0.53) ALDH1A1KDM4ESIGMAR1CYP3A4TSHR
SCHEMBL4917701 0.85 ALDH1A1 (0.56) ALDH1A1KDM4ESIGMAR1CYP3A4TSHR
SCHEMBL3400591 0.84 ALDH1A1 (0.61) ALDH1A1KDM4ESIGMAR1CYP3A4TSHR
SCHEMBL19295582 0.81 SIGMAR1 (0.57) ALDH1A1KDM4ESIGMAR1KCNH2CYP1A2
N-Benzylmethylamine SCHEMBL10738170 0.80 ALDH1A1 (0.61) ALDH1A1KDM4ESIGMAR1CYP3A4TSHR
SCHEMBL10964949 0.80 ALDH1A1 (0.53) ALDH1A1KDM4ECYP3A4TSHR
SCHEMBL7603827 0.79 ALDH1A1 (0.56) ALDH1A1KDM4ESIGMAR1CYP3A4TSHR
SCHEMBL23665707 0.78 ALDH1A1 (0.55) ALDH1A1KDM4ESIGMAR1CYP3A4TSHR
SCHEMBL4909383 0.77 TSHR (0.82) ALDH1A1KDM4ECYP3A4TSHRCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116635508-A Alkaline ashless additive and lubricating composition containing the same 路博润公司 2023-08-22 CN disclosed
US-20080019930-A1 Dibenzoylmethane sunscreens photostabilized with arylalkyl amide or ester compounds L'OREAL (FR) 2008-01-24 US disclosed
CN-101095648-A Dibenzoylmethane sunscreens photostabilized with arylalkyl amide or ester compounds OREAL (FR) 2008-01-02 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 (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-20080019930-A1 Dibenzoylmethane sunscreens photostabilized with arylalkyl amide or ester compounds TYR, DDT, AADAC ALDH1A1 110/4885KDM4E 1701/4885SIGMAR1 4652/4885

“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.