SCHEMBL6728833

SCHEMBL6728833

CCn1ncc(C(=O)c2cc(C)c3c(c2C)C=CCS3)c1O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL6721329 0.77 LMNA (0.34) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL8895824 0.77 SMN1; SMN2 (0.33) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL8123433 0.76 RAB9A (0.33) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL8892726 0.74 ALDH1A1 (0.35) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL8588694 0.73 RAB9A (0.32) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL27524777 0.73 LMNA (0.44) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL8509129 0.73 DRD2 (0.42) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL8940911 0.73 RAB9A (0.31) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL6721363 0.72 NOTUM (0.34) LMNAALDH1A1
SCHEMBL8941039 0.72 PDE4B (0.32) RAB9ASMN1; SMN2LMNAALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6677460-B1 Aromatic carboxylic acid bicyclic sulfur compounds IDEMITSU KOSAN COMPANY, LIMITED (JP) 2004-01-13 US disclosed
US-20030236421-A1 AROMATIC CARBOXYLIC ACID BICYCLIC SULFUR COMPOUNDS IDEMITSU KOSAN COMPANY, LIMITED (JP) 2003-12-25 US disclosed
US-20010051733-A1 Aromatic carboxylic acid bicyclic sulfur compounds IDEMITSU KOSAN COMPANY, LIMITED (JP) 2001-12-13 US disclosed
US-6136755-A HERBICIDES IDEMITSU KOSAN CO., LTD. (JP) 2000-10-24 US disclosed
US-6103668-A Pyrazole derivatives IDEMITSU KOSAN CO., LTD. (JP) 2000-08-15 US disclosed
US-6063936-A CARBOXY SUBSTITUTED BENZOTHIOPHENES USED AS HERBICIDE IDEMITSU KOSAN CO., LTD. (JP) 2000-05-16 US disclosed
US-5767289-A HERBICIDE INTERMEDIATES IDEMITSU KOSAN COMPANY, LIMITED (JP) 1998-06-16 US disclosed
EP-0810226-A1 PYRAZOLE DERIVATIVES IDEMITSU KOSAN COMPANY LIMITED (JP) 1997-12-03 EP disclosed
US-5607898-A HERBICIDES IDEMITSU KOSAN COMPANY, LTD. (JP) 1997-03-04 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 (2 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-20030236421-A1 AROMATIC CARBOXYLIC ACID BICYCLIC SULFUR COMPOUNDS XDH, SULT2A1, NAT1 RAB9A 2907/4885SMN1; SMN2 3397/4885LMNA 4586/4885
US-20010051733-A1 Aromatic carboxylic acid bicyclic sulfur compounds XDH, SULT2A1, NAT1 RAB9A 2907/4885SMN1; SMN2 3397/4885LMNA 4586/4885

“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.