SCHEMBL12480223

SCHEMBL12480223

C[C@@H]1CCN([C@@H](C)c2ccccc2)[C@@H]1C(=O)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
HTR2C P28335 1/20 0.43
CTSL P07711 1/20 0.43
FKBP1A P62942 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
FABP7 O15540 1/20 0.40
FABP5 Q01469 1/20 0.40
CHRM4 P08173 1/20 0.40
CYP2C19 P33261 3/20 0.40
CYP2C9 P11712 2/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP1A2 P05177 1/20 0.40
POLB P06746 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
KMT2A Q03164 1/20 0.39

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
SCHEMBL29820127 0.88 ALDH1A1 (0.50) TSHRSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL29819789 0.88 ALDH1A1 (0.50) TSHRSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL7064400 0.84 FKBP1A (0.50) TSHRHTR2CFKBP1ASMN1; SMN2NPC1
SCHEMBL1022236 0.84 CYP2D6 (0.42) TSHRCHRM4ALDH1A1CYP1A2CYP3A4
SCHEMBL1022238 0.84 CYP2D6 (0.42) TSHRCHRM4ALDH1A1CYP1A2CYP3A4
SCHEMBL22646891 0.83 TSHR (0.44) TSHRHTR2CFKBP1ASMN1; SMN2NPC1
SCHEMBL943708 0.81 KMT2A (0.43) NPC1CHRM4ALDH1A1CYP2D6KMT2A
SCHEMBL6079535 0.81 KMT2A (0.43) NPC1CHRM4ALDH1A1CYP2D6KMT2A
SCHEMBL27156366 0.81 KMT2A (0.43) NPC1CHRM4ALDH1A1CYP2D6KMT2A
SCHEMBL11014713 0.79 TSHR (0.43) TSHRHTR2CCTSLFKBP1ASMN1; SMN2

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
EP-2661433-B1 INDOLE COMPOUNDS OR ANALOGUES THEREOF USEFUL FOR THE TREATMENT OF AGE-RELATED MACULAR DEGENERATION (AMD) NOVARTIS AG (CH) 2017-08-16 EP disclosed
US-9085555-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2015-07-21 US disclosed
EP-2675458-A1 COMPOUNDS AND METHODS FOR TREATMENT OF HYPERTENSION Medivation Technologies, Inc. (US) 2013-12-25 EP disclosed
EP-2675459-A1 COMPOUNDS AND METHODS OF TREATING DIABETES Medivation Technologies, Inc. (US) 2013-12-25 EP disclosed
EP-2661433-A1 INDOLE COMPOUNDS OR ANALOGUES THEREOF USEFUL FOR THE TREATMENT OF AGE-RELATED MACULAR DEGENERATION (AMD) Novartis AG (CH) 2013-11-13 EP disclosed
US-20120295884-A1 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2012-11-22 US disclosed
WO-2012154261-A1 COMPOUNDS AND METHODS OF TREATING DIABETES MEDIVATION TECHNOLOGIES, INC. (US) 2012-11-15 WO disclosed
WO-2012112966-A1 COMPOUNDS AND METHODS FOR TREATMENT OF HYPERTENSION MEDIVATION TECHNOLOGIES, INC. (US) 2012-08-23 WO disclosed
WO-2012093101-A1 INDOLE COMPOUNDS OR ANALOGUES THEREOF USEFUL FOR THE TREATMENT OF AGE-RELATED MACULAR DEGENERATION (AMD) NOVARTIS AG (CH) 2012-07-12 WO 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-20120295884-A1 Complement pathway modulators and uses thereof C5, C3AR1, C9 TSHR 2475/4885HTR2C 2124/4885CTSL 1024/4885

“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.