SCHEMBL19002867

SCHEMBL19002867

CC(C)CCNc1cnccn1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.59
▸ KDM4E B2RXH2 7/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ HPGD P15428 4/20 0.47
▸ PCSK9 Q8NBP7 1/20 0.47
▸ KMT2A Q03164 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ CYP1A2 P05177 2/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ ALOX12 P18054 1/20 0.39
▸ RAB9A P51151 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ GAA P10253 2/20 0.36
▸ THRB P10828 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ UTS2R Q9UKP6 1/20 0.35

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
SCHEMBL21527350 0.91 ALDH1A1 (0.57) ALDH1A1KDM4ESMN1; SMN2HPGDPCSK9
SCHEMBL3956912 0.81 ALDH1A1 (0.73) ALDH1A1KDM4ESMN1; SMN2HPGDPCSK9
SCHEMBL24347355 0.80 ALDH1A1 (0.57) ALDH1A1KDM4ESMN1; SMN2HPGDPCSK9
SCHEMBL10670706 0.79 KDM4E (0.55) ALDH1A1KDM4ESMN1; SMN2HPGDPCSK9
SCHEMBL11463094 0.77 ALDH1A1 (0.54) ALDH1A1KDM4ESMN1; SMN2HPGDPCSK9
SCHEMBL22242100 0.77 ALDH1A1 (0.53) ALDH1A1KDM4ESMN1; SMN2HPGDPCSK9
SCHEMBL31452231 0.77 ALDH1A1 (0.53) ALDH1A1KDM4ESMN1; SMN2HPGDPCSK9
SCHEMBL10684352 0.76 KDM4E (0.51) ALDH1A1KDM4ESMN1; SMN2HPGDPCSK9
SCHEMBL1965855 0.75 ALDH1A1 (0.55) ALDH1A1KDM4ESMN1; SMN2HPGDPCSK9
SCHEMBL30775403 0.75 ALDH1A1 (0.55) ALDH1A1KDM4ESMN1; SMN2HPGDPCSK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10870657-B2 Compounds for the treatment of cancer and inflammatory disease SHY Therapeutics LLC (US) 2020-12-22 — — US disclosed
US-20190218229-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMTORY DISEASE SHY Therapeutics LLC 2019-07-18 — — US disclosed
US-10221191-B2 Compounds for the treatment of cancer and inflammatory disease SHY Therapeutics LLC 2019-03-05 — — US disclosed
US-20170174699-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE SHY Therapeutics LLC 2017-06-22 — — 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-10221191-B2 Compounds for the treatment of cancer and inflammatory disease MAPK6, MAP3K6, MAPK4 ALDH1A1 2765/4885KDM4E 3392/4885SMN1; SMN2 4331/4885
US-20190218229-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMTORY DISEASE MAPK1, MAPK6, MAP3K1 ALDH1A1 2861/4885KDM4E 3018/4885SMN1; SMN2 4558/4885
US-10870657-B2 Compounds for the treatment of cancer and inflammatory disease MAPK6, MAP3K6, MAPK4 ALDH1A1 2765/4885KDM4E 3392/4885SMN1; SMN2 4331/4885
US-20170174699-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE MAPK6, MAP3K6, MAPK4 ALDH1A1 2765/4885KDM4E 3392/4885SMN1; SMN2 4331/4885

“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.

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