SCHEMBL19628622

SCHEMBL19628622

Cc1ccc(C2C[C@H]2C(=O)O)cc1

nearest known ligand 0.81

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.81
ALDH1A1 P00352 5/20 0.64
CYP1A2 P05177 1/20 0.64
CYP3A4 P08684 1/20 0.64
CYP2C9 P11712 1/20 0.64
CYP2C19 P33261 1/20 0.64
FFAR4 Q5NUL3 4/20 0.53
TDP1 Q9NUW8 1/20 0.51
IDO1 P14902 2/20 0.46
LMNA P02545 2/20 0.46
TP53 P04637 2/20 0.46
HDAC4 P56524 1/20 0.46
HPGD P15428 1/20 0.46
MAPT P10636 1/20 0.45
ALOX12 P18054 1/20 0.45

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
SCHEMBL4209116 1.00 FFAR1 (0.81) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL12466620 1.00 FFAR1 (0.81) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL799468 1.00 FFAR1 (0.81) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL301501 1.00 FFAR1 (0.81) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL4203114 1.00 FFAR1 (0.81) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL12646402 0.94 FFAR1 (0.73) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL1550383 0.90 FFAR1 (1.00) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL21845792 0.84 ALDH1A1 (0.64) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL799523 0.84 ALDH1A1 (0.64) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL16232159 0.84 ALDH1A1 (0.64) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11655226-B2 KDM1A inhibitors for the treatment of disease IMAGO BIOSCIENCES, INC. (US) 2023-05-23 US disclosed
US-20170334873-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE IMAGO BIOSCIENCES, INC. 2017-11-23 US disclosed
US-9790195-B2 KDM1A inhibitors for the treatment of disease IMAGO BIOSCIENCES, INC. (US) 2017-10-17 US disclosed
US-20160257662-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE IMAGO BIOSCIENCES, INC. 2016-09-08 US disclosed
US-20120202794-A1 COMPOUNDS PHARMASSET, INC. (US) 2012-08-09 US disclosed
US-20120202794-A1 COMPOUNDS PHARMASSET, INC. (US) 2012-08-09 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 (4 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-20120202794-A1 COMPOUNDS HAVCR2, MAVS, GOT2 FFAR1 2319/4885ALDH1A1 253/4885CYP1A2 820/4885
US-20170334873-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE KDM1B, KDM1A, KDM2A FFAR1 4334/4885ALDH1A1 734/4885CYP1A2 3176/4885
US-20160257662-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE KDM1B, KDM1A, KDM2A FFAR1 4403/4885ALDH1A1 969/4885CYP1A2 3261/4885
US-11655226-B2 KDM1A inhibitors for the treatment of disease KDM1B, KDM1A, KDM2A FFAR1 4334/4885ALDH1A1 734/4885CYP1A2 3176/4885

“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.