SCHEMBL7119295

SCHEMBL7119295

Cc1cc([N+](=O)[O-])ccc1/N=C1\SCCN1CC1CCCCCCCCCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ CRHBP P24387 1/20 0.41
▸ CRHR2 Q13324 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ RAB9A P51151 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ AR P10275 1/20 0.36
▸ CYP19A1 P11511 2/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ GRIN2D O15399 1/20 0.34
▸ GRIN3B O60391 1/20 0.34
▸ GRIN1 Q05586 1/20 0.34
▸ GRIN2A Q12879 1/20 0.34
▸ GRIN2B Q13224 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
SCHEMBL7118286 1.00 ALDH1A1 (0.41) ALDH1A1LMNAMAPTCRHBPCRHR2
SCHEMBL7118260 1.00 ALDH1A1 (0.41) ALDH1A1LMNAMAPTCRHBPCRHR2
SCHEMBL7119301 1.00 ALDH1A1 (0.41) ALDH1A1LMNAMAPTCRHBPCRHR2
SCHEMBL7118284 1.00 ALDH1A1 (0.41) ALDH1A1LMNAMAPTCRHBPCRHR2
SCHEMBL7118257 1.00 ALDH1A1 (0.41) ALDH1A1LMNAMAPTCRHBPCRHR2
SCHEMBL7119889 0.99 ALDH1A1 (0.42) ALDH1A1LMNAMAPTCRHBPCRHR2
SCHEMBL7119892 0.99 ALDH1A1 (0.42) ALDH1A1LMNAMAPTCRHBPCRHR2
SCHEMBL7119217 0.95 ALDH1A1 (0.39) ALDH1A1LMNAMAPTCRHBPCRHR2
SCHEMBL7119222 0.95 ALDH1A1 (0.39) ALDH1A1LMNAMAPTCRHBPCRHR2
SCHEMBL7114268 0.87 MPI (0.42) ALDH1A1LMNAMAPTSMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030207865-A1 Substituted 2-arylimino heterocycles and compositions containing them for use as progesterone receptor binding agents DIXON BRIAN R (US) 2003-11-06 — — US disclosed
US-6353006-B1 TREATMENT OF BONE DISORDERS, OSTEOPOROSIS AND HEALING AGENT BAYER CORPORATION 2002-03-05 — — 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-20030207865-A1 Substituted 2-arylimino heterocycles and compositions containing them for use as progesterone receptor binding agents PGR, PGRMC2, PGRMC1 ALDH1A1 587/4885LMNA 3221/4885MAPT 4372/4885

“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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